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Search results for: '844-519-8'

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  1. Aniline hydrochloride
    13 Citations
    Cas Number:  142-04-1       EC Number: MFCD00012958
    Formula:  C6H5NH2·HCl
    Molecular weight:  129.59
    Synonyms:  Hydrochloride benzenamide | Tox21_302869 | EINECS 205-519-8 | NCI-C03736 hydrochloride | CAS-142-04-...
    SMILES:  C1=CC=C(C=C1)N.Cl
    InChIKey:  MMCPOSDMTGQNKG-UHFFFAOYSA-N
    InChI:  InChI=1S/C6H7N.ClH/c7-6-4-2-1-3-5-6;/h1-5H,7H2;1H
  2. Matrine
    26 Citations
    Cas Number:  519-02-8
    Formula:  C15H24N2O
    Molecular weight:  248.36
    Synonyms:  Matrine|519-02-8|(+)-Matrine|Matridin-15-one|Matrinium|Vegard|alpha-Matrine|Matrene, (+)-|NSC 146051...
    SMILES:  C1CC2C3CCCN4C3C(CCC4)CN2C(=O)C1
    InChIKey:  ZSBXGIUJOOQZMP-JLNYLFASSA-N
    InChI:  InChI=1S/C15H24N2O/c18-14-7-1-6-13-12-5-3-9-16-8-2-4-11(15(12)16)10-17(13)14/h11-13,15H,1-10H2/t11-,12+,13+,15-/m0/s1
  3. tert-butyl 5-bromopentanoate
    Cas Number:  88987-42-2       EC Number: 844-519-8
    Formula:  C9H17BrO2
    Molecular weight:  237.14
    Synonyms:  SY037025 | tert-Butyl 5-bromovalerate | 5-Bromopentanoic acid, t-butyl ester | CS-0041680 | F20036 |...
    SMILES:  CC(C)(C)OC(=O)CCCCBr
    InChIKey:  UYDIIUHJHUZDME-UHFFFAOYSA-N
    InChI:  InChI=1S/C9H17BrO2/c1-9(2,3)12-8(11)6-4-5-7-10/h4-7H2,1-3H3
  4. 4-Bromo-2-methylaniline
    Cas Number:  583-75-5       EC Number: 209-519-9
    Formula:  C7H8BrN
    Molecular weight:  186.05
    Synonyms:  EN300-21104 | AKOS000121494 | BCP23023 | 4-bromo-2-methylphenylamine | MFCD00007825 | 4-bromo-2-meth...
    SMILES:  CC1=C(C=CC(=C1)Br)N
    InChIKey:  PCHYYOCUCGCSBU-UHFFFAOYSA-N
    InChI:  InChI=1S/C7H8BrN/c1-5-4-6(8)2-3-7(5)9/h2-4H,9H2,1H3
  5. tert-butyl (1S,2S,5S)-2-amino-8-azabicyclo[3.2.1]octane-8-carboxylate
    Cas Number:  1932494-74-0
    Formula:  C12H22N2O2
    Molecular weight:  226.31
    Synonyms:  tert-butyl (1S,2S,5S)-2-amino-8-azabicyclo[3.2.1]octane-8-carboxylate | 1932494-74-0 | endo-8-Boc-8-...
    SMILES:  CC(C)(C)OC(=O)N1C2CCC(C1CC2)N
    InChIKey:  LJSMXQVRQBFKNF-GUBZILKMSA-N
    InChI:  InChI=1S/C12H22N2O2/c1-12(2,3)16-11(15)14-8-4-6-9(13)10(14)7-5-8/h8-10H,4-7,13H2,1-3H3/t8-,9-,10-/m0/s1
  6. JTV 519 fumarate
    Cas Number:  1883549-36-7
    Formula:  C25H32N2O2S·C4H4O4
    Molecular weight:  540.67
    Synonyms:  3-(4-Benzylpiperidin-1-yl)-1-(7-methoxy-3,5-dihydro-2H-1,4-benzothiazepin-4-yl)propan-1-one(E)-but-2...
    SMILES:  COC1=CC2=C(C=C1)SCCN(C2)C(=O)CCN3CCC(CC3)CC4=CC=CC=C4.C(=CC(=O)O)C(=O)O
    InChIKey:  ISLOBKLDZGDFTB-WLHGVMLRSA-N
    InChI:  InChI=1S/C25H32N2O2S.C4H4O4/c1-29-23-7-8-24-22(18-23)19-27(15-16-30-24)25(28)11-14-26-12-9-21(10-13-26)17-20-5-3-2-4-6-20;5-3(6)1-2-4(7)8/h2-8,18,21H,9-17,19H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+
  7. , Apoptosis regulator Bcl-2 inhibitor
    Venetoclax (ABT-199), Apoptosis regulator Bcl-2 inhibitor
    1 Citations
    Cas Number:  1257044-40-8(DMSO)
    Formula:  C45H50ClN7O7S
    Molecular weight:  868.44
    Synonyms:  GDC-0199 | Benzamide, 4-[4-[[2-(4-chlorophenyl)-4,4-dimethyl-1-cyclohexen-1-yl]methyl]-1-piperazinyl...
    SMILES:  CC1(C)CCC(=C(C1)C2=CC=C(Cl)C=C2)CN3CCN(CC3)C4=CC(=C(C=C4)C(=O)N[S](=O)(=O)C5=CC=C(NCC6CCOCC6)C(=C5)[N+]([O-])=O)OC7=CN=C8[NH]C=CC8=C7
  8. , Cholesteryl ester transfer protein inhibitor
    CKD-519, Cholesteryl ester transfer protein inhibitor
    Cas Number:  1402796-27-3
    Formula:  C31H34F7NO3
    Molecular weight:  601.60
    Synonyms:  CKD-519 | DB15437 | Rocacetrapib [INN] | GBHPDJQHZADVAA-SOKVYYICSA-N | UNII-K9SP3L3YQP | 2-Oxazolidi...
    SMILES:  CC1C(OC(=O)N1CC2=C(CCC(C2)(C)C)C3=CC(=C(C=C3OC)F)C(C)C)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F
    InChIKey:  GBHPDJQHZADVAA-SOKVYYICSA-N
    InChI:  InChI=1S/C31H34F7NO3/c1-16(2)23-12-24(26(41-6)13-25(23)32)22-7-8-29(4,5)14-19(22)15-39-17(3)27(42-28(39)40)18-9-20(30(33,34)35)11-21(10-18)31(36,37)38/h9-13,16-17,27H,7-8,14-15H2,1-6H3/t17-,27-/m0/s1
  9. Pirenzepine dihydrochloride
    Cas Number:  29868-97-1       EC Number: 249-907-5
    Formula:  C19H21N5O2·2HCl
    Molecular weight:  424.32
    Synonyms:  Pirenzepine dihydrochloride|29868-97-1|Pirenzepine hydrochloride|Pirenzepine HCl|Tabe|Pirenzepine 2H...
    SMILES:  CN1CCN(CC1)CC(=O)N2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4.Cl.Cl
    InChIKey:  FFNMBRCFFADNAO-UHFFFAOYSA-N
    InChI:  InChI=1S/C19H21N5O2.2ClH/c1-22-9-11-23(12-10-22)13-17(25)24-16-7-3-2-5-14(16)19(26)21-15-6-4-8-20-18(15)24;;/h2-8H,9-13H2,1H3,(H,21,26);2*1H
  10. 2， 4-DICHLORO-6-ETHYLPYRIMIDINE
    Cas Number:  6554-65-0       EC Number: 844-844-5
    SMILES:  CCC1=CC(=NC(=N1)Cl)Cl
    InChIKey:  ZEGCKSCTOWFFRE-UHFFFAOYSA-N
    InChI:  InChI=1S/C6H6Cl2N2/c1-2-4-3-5(7)10-6(8)9-4/h3H,2H2,1H3
  11. ON1231320
    Cas Number:  1312471-39-8
    Formula:  C22H15F2N5O3S
    Molecular weight:  467.45
    SMILES:  O=C1C(S(=O)(C2=CC=C(F)C=C2F)=O)=CC3=CN=C(NC4=CC5=C(NC=C5)C=C4)N=C3N1C
  12. B-hydroxyethyltheophylline
    1 Citations
    Cas Number:  519-37-9
    Formula:  C9H12N4O3
    Molecular weight:  224.22
    Synonyms:  ETOFYLLINE|519-37-9|7-(2-Hydroxyethyl)theophylline|Aethophyllinum|Oxyphylline|Cordalin|Frekaphyllin|...
    SMILES:  CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCO
    InChIKey:  NWPRCRWQMGIBOT-UHFFFAOYSA-N
    InChI:  InChI=1S/C9H12N4O3/c1-11-7-6(8(15)12(2)9(11)16)13(3-4-14)5-10-7/h5,14H,3-4H2,1-2H3
  13. 2-Heptanol
    5 Citations
    Cas Number:  543-49-7       EC Number: 208-844-3
    Formula:  C7H16O
    Molecular weight:  116.2
    Synonyms:  EINECS 208-844-3 | STR03657 | AI3-11263 | NSC 2220 | 2-Heptanol, >=97%, FG | (+/-)-2-Heptanol | 2-He...
    SMILES:  CCCCCC(C)O
    InChIKey:  CETWDUZRCINIHU-UHFFFAOYSA-N
    InChI:  InChI=1S/C7H16O/c1-3-4-5-6-7(2)8/h7-8H,3-6H2,1-2H3
  14. 2,5-Diphenyl-1,4-benzoquinone
    1 Citations
    Cas Number:  844-51-9
    Formula:  C18H12O2
    Molecular weight:  260.29
    Synonyms:  844-51-9|2,5-Diphenyl-1,4-benzoquinone|2,5-Diphenyl-p-benzoquinone|2,5-Diphenylquinone|2,5-diphenylc...
    SMILES:  C1=CC=C(C=C1)C2=CC(=O)C(=CC2=O)C3=CC=CC=C3
    InChIKey:  QYXHDJJYVDLECA-UHFFFAOYSA-N
    InChI:  InChI=1S/C18H12O2/c19-17-12-16(14-9-5-2-6-10-14)18(20)11-15(17)13-7-3-1-4-8-13/h1-12H
  15. 4-Tridecanone
    Cas Number:  26215-90-7
    Formula:  C13H26O
    Molecular weight:  198.34
    Synonyms:  Nonyl propyl ketone | Q63W356HC2 | BBA21590 | n-Nonyl n-propyl ketone | n-Propyl n-nonyl ketone | 4-...
    SMILES:  CCCCCCCCCC(=O)CCC
    InChIKey:  JWSRUPAFLPWLNO-UHFFFAOYSA-N
    InChI:  InChI=1S/C13H26O/c1-3-5-6-7-8-9-10-12-13(14)11-4-2/h3-12H2,1-2H3
  16. myo-Inositol Hexaacetate
    Cas Number:  1254-38-2
    Formula:  C18H24O12
    Molecular weight:  432.38
    Synonyms:  1,2,3,4,5,6-Hexa-O-acetyl-myo-inositol | AKOS030241399 | SCHEMBL7151553 | EINECS 207-844-0 | 1,2,3,4...
    SMILES:  CC(=O)OC1C(C(C(C(C1OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C
    InChIKey:  SQUHHTBVTRBESD-UHFFFAOYSA-N
    InChI:  InChI=1S/C18H24O12/c1-7(19)25-13-14(26-8(2)20)16(28-10(4)22)18(30-12(6)24)17(29-11(5)23)15(13)27-9(3)21/h13-18H,1-6H3
  17. 2-Phenyloxazole-4-carbaldehyde
    Cas Number:  20771-08-8       EC Number: 844-562-2
    Formula:  C10H7NO2
    Molecular weight:  173.17
    SMILES:  C1=CC=C(C=C1)C2=NC(=CO2)C=O
    InChIKey:  SMJNJCYAIKTNKK-UHFFFAOYSA-N
    InChI:  InChI=1S/C10H7NO2/c12-6-9-7-13-10(11-9)8-4-2-1-3-5-8/h1-7H
  18. 7-Methoxy-2H-chromene-3-carbonitrile
    Cas Number:  57543-70-1       EC Number: 844-955-9
    SMILES:  COC1=CC2=C(C=C1)C=C(CO2)C#N
    InChIKey:  VSQUWMPCKWVPTQ-UHFFFAOYSA-N
    InChI:  InChI=1S/C11H9NO2/c1-13-10-3-2-9-4-8(6-12)7-14-11(9)5-10/h2-5H,7H2,1H3
  19. , Muscarinic acetylcholine receptor M1 antagonist
    Pirenzepine, Muscarinic acetylcholine receptor M1 antagonist
    1 Citations
    Cas Number:  28797-61-7
    Formula:  C19H21N5O2
    Molecular weight:  351.4
    Synonyms:  Tox21_110239_1 | BRN 0628987 | ACI-91 | FT-0600051 | KBio3_002445 | NCGC00015836-03 | NCGC00015836-0...
    SMILES:  CN1CCN(CC1)CC(=O)N2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4
    InChIKey:  RMHMFHUVIITRHF-UHFFFAOYSA-N
    InChI:  InChI=1S/C19H21N5O2/c1-22-9-11-23(12-10-22)13-17(25)24-16-7-3-2-5-14(16)19(26)21-15-6-4-8-20-18(15)24/h2-8H,9-13H2,1H3,(H,21,26)
  20. (2-Fluoro-4-methoxyphenyl)methanamine hydrochloride
    Cas Number:  937783-85-2       EC Number: 844-277-3
    Formula:  C8H11ClFNO
    Molecular weight:  191.63
    SMILES:  COC1=CC(=C(C=C1)CN)F.Cl
    InChIKey:  GLRBPLAFPRZPAI-UHFFFAOYSA-N
    InChI:  InChI=1S/C8H10FNO.ClH/c1-11-7-3-2-6(5-10)8(9)4-7;/h2-4H,5,10H2,1H3;1H
  21. (2-Methoxy-4-methylphenyl)boronic acid
    Cas Number:  198211-79-9       EC Number: 844-754-6
    SMILES:  B(C1=C(C=C(C=C1)C)OC)(O)O
    InChIKey:  LWNWZQJRSFHZRG-UHFFFAOYSA-N
    InChI:  InChI=1S/C8H11BO3/c1-6-3-4-7(9(10)11)8(5-6)12-2/h3-5,10-11H,1-2H3
  22. 2-Hydroxy-6-methoxybenzaldehyde
    Cas Number:  700-44-7
    Formula:  C8H8O3
    Molecular weight:  152.15
    Synonyms:  A9258 | AKOS000269266 | CL8288 | 6-Hydroxy-o-anisaldehyde 6-Methoxysalicylaldehyde | 6-Methoxysalicy...
    SMILES:  COC1=CC=CC(=C1C=O)O
    InChIKey:  DZJPDDVDKXHRLF-UHFFFAOYSA-N
    InChI:  InChI=1S/C8H8O3/c1-11-8-4-2-3-7(10)6(8)5-9/h2-5,10H,1H3
  23. 4-(3-Methoxyphenyl)piperidine
    Cas Number:  99329-55-2       EC Number: 844-568-5
    Formula:  C12H17NO
    Molecular weight:  191.27
    SMILES:  COC1=CC=CC(=C1)C2CCNCC2
    InChIKey:  NONQCMNVMIGQEE-UHFFFAOYSA-N
    InChI:  InChI=1S/C12H17NO/c1-14-12-4-2-3-11(9-12)10-5-7-13-8-6-10/h2-4,9-10,13H,5-8H2,1H3
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