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1,4-benzodiazepines

Description:

Organic compounds containing a benzene ring fused to a 1,4-azepine.

Ancestors:

Organic compounds ⮕ Organoheterocyclic compounds ⮕ Benzodiazepines ⮕ 1,4-benzodiazepines
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Items 25-36 of 95

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  1. GSK-3 inhibitor 1
      Grade & Purity: 
    • ≥98%
    Cas Number: 603272-51-1        Compound CID:  78357782
    Formula:  C22H17ClFN5O2        Molecular Weight: 437.85
    IUPAC Name:  3-(6-fluoro-1,10-diazatricyclo[6.4.1.04,13]trideca-2,4,6,8(13)-tetraen-3-yl)-4-imidazo[1,2-a]pyridin-3-ylpyrrole-2,5-dione;hydrochloride
    SMILES:  C1CN2C=C(C3=CC(=CC(=C32)CN1)F)C4=C(C(=O)NC4=O)C5=CN=C6N5C=CC=C6.Cl
    InChIKey: CXXAOCQHGIGIBJ-UHFFFAOYSA-N
    InChI:  InChI=1S/C22H16FN5O2.ClH/c23-13-7-12-9-24-4-6-27-11-15(14(8-13)20(12)27)18-19(22(30)26-21(18)29)16-10-25-17-3-1-2-5-28(16)17;/h1-3,5,7-8,10-11,24H,4,6show more
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  2. SG2057
      Grade & Purity: 
    • ≥98%
    Cas Number: 260417-62-7        Compound CID:  9938287
    Formula:  C33H36N4O6        Molecular Weight: 584.66
    SMILES:  COC1=C(C=C2C(=C1)C(=O)N3CC(=C)C[C@H]3C=N2)OCCCCCOC4=C(C=C5C(=C4)N=C[C@@H]6CC(=C)CN6C5=O)OC
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  3. SJG-136
    Cas Number: 232931-57-6
    Formula:  C31H32N4O6        Molecular Weight: 556.61
    IUPAC Name:  (6aS)-3-[3-[[(6aS)-2-methoxy-8-methylidene-11-oxo-7,9-dihydro-6aH-pyrrolo[2,1-c][1,4]benzodiazepin-3-yl]oxy]propoxy]-2-methoxy-8-methylidene-7,9-dihydshow more
    SMILES:  COC1=C(C=C2C(=C1)C(=O)N3CC(=C)CC3C=N2)OCCCOC4=C(C=C5C(=C4)N=CC6CC(=C)CN6C5=O)OC
    InChIKey: RWZVMMQNDHPRQD-SFTDATJTSA-N
    InChI:  InChI=1S/C31H32N4O6/c1-18-8-20-14-32-24-12-28(26(38-3)10-22(24)30(36)34(20)16-18)40-6-5-7-41-29-13-25-23(11-27(29)39-4)31(37)35-17-19(2)9-21(35)15-33-show more
    Synonyms: SJG 136 [WHO-DD] | (6aS)-3-[3-[[(6aS)-2-methoxy-8-methylidene-11-oxo-7,9-dihydro-6aH-pyrrolo[2,1-c][1,4]benzodiazepin...
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  4. CCK-B Receptor Antagonist 2
      Grade & Purity: 
    • ≥98%
    Cas Number: 155412-88-7        Compound CID:  23844130
    Formula:  C27H28N6O3        Molecular Weight: 484.55
    IUPAC Name:  1-(3-aminophenyl)-3-[(3R)-1-(3,3-dimethyl-2-oxobutyl)-2-oxo-5-pyridin-2-yl-3H-1,4-benzodiazepin-3-yl]urea
    SMILES:  CC(C)(C)C(=O)CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)NC3=CC=CC(=C3)N)C4=CC=CC=N4
    InChIKey: ABJHMASUFPDZRW-DEOSSOPVSA-N
    InChI:  InChI=1S/C27H28N6O3/c1-27(2,3)22(34)16-33-21-13-5-4-11-19(21)23(20-12-6-7-14-29-20)31-24(25(33)35)32-26(36)30-18-10-8-9-17(28)15-18/h4-15,24H,16,28H2,show more
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  5. Vabicaserin hydrochloride
      Grade & Purity: 
    • ≥96%
    Cas Number: 887258-94-8        EC Number: 618-208-0        Compound CID:  11521821
    Formula:  C15H21ClN2        Molecular Weight: 264.79
    IUPAC Name:  (12R,16S)-7,10-diazatetracyclo[8.6.1.05,17.012,16]heptadeca-1,3,5(17)-triene;hydrochloride
    SMILES:  C1CC2CN3CCNCC4=C3C(=CC=C4)C2C1.Cl
    InChIKey: PYPPENBDXAWXJC-QNTKWALQSA-N
    InChI:  InChI=1S/C15H20N2.ClH/c1-3-11-9-16-7-8-17-10-12-4-2-5-13(12)14(6-1)15(11)17;/h1,3,6,12-13,16H,2,4-5,7-10H2;1H/t12-,13-;/m0./s1
    Synonyms: (12R,16S)-7,10-diazatetracyclo[8.6.1.05,17.012,16]heptadeca-1,3,5(17)-triene;hydrochloride | 887258-94-8 (HCl) | DTXS...
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  6. 1'-Hydroxymidazolam
      Grade & Purity: 
    • ≥98%
    Cas Number: 59468-90-5        Compound CID:  107917
    Formula:  C18H13ClFN3O        Molecular Weight: 341.77
    IUPAC Name:  [8-chloro-6-(2-fluorophenyl)-4H-imidazo[1,5-a][1,4]benzodiazepin-1-yl]methanol
    SMILES:  C1C2=CN=C(N2C3=C(C=C(C=C3)Cl)C(=N1)C4=CC=CC=C4F)CO
    InChIKey: QHSMEGADRFZVNE-UHFFFAOYSA-N
    InChI:  InChI=1S/C18H13ClFN3O/c19-11-5-6-16-14(7-11)18(13-3-1-2-4-15(13)20)22-9-12-8-21-17(10-24)23(12)16/h1-8,24H,9-10H2
    Synonyms: 8-Chloro-6-(2-fluorophenyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-1-methanol | 1'-Hydroxy Midazolam | MS-25227 | alpha...
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  7. Molibresib besylate
      Grade & Purity: 
    • ≥99%
    Cas Number: 1895049-20-3        Compound CID:  133082230
    Formula:  C28H28ClN5O5S        Molecular Weight: 582.07
    IUPAC Name:  benzenesulfonic acid;2-[(4S)-6-(4-chlorophenyl)-8-methoxy-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-4-yl]-N-ethylacetamide
    SMILES:  CCNC(=O)CC1C2=NN=C(N2C3=C(C=C(C=C3)OC)C(=N1)C4=CC=C(C=C4)Cl)C.C1=CC=C(C=C1)S(=O)(=O)O
    InChIKey: UQGMFOYDYUZADE-FERBBOLQSA-N
    InChI:  InChI=1S/C22H22ClN5O2.C6H6O3S/c1-4-24-20(29)12-18-22-27-26-13(2)28(22)19-10-9-16(30-3)11-17(19)21(25-18)14-5-7-15(23)8-6-14;7-10(8,9)6-4-2-1-3-5-6/h5-show more
    Synonyms: MS-30436 | Molibresib besylate (USAN) | MOLIBRESIB BESYLATE [USAN] | Molibresib besylate | 2-[(4S)-6-(4-Chlorophenyl)...
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  9. [³H]pirenzepine
    IUPAC Name:  11-[2-[4-(tritritiomethyl)piperazin-1-yl]acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
    SMILES:  O=C(n1c2ccccc2c(=O)[nH]c2c1nccc2)CN1CCN(CC1)C([3H])([3H])[3H]
    InChIKey: RMHMFHUVIITRHF-RLXJOQACSA-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)/i1T3
    Synonyms: [³H]PZ
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  10. [³H]AF DX-384
    IUPAC Name:  N-[2-[2-[(dipropylamino)methyl]piperidin-1-yl]ethyl]-6-oxo-5H-pyrido[2,3-b][1,4]benzodiazepine-11-carboxamide
    SMILES:  CCCN(CC1CCCCN1CCNC(=O)n1c2ccccc2c(=O)[nH]c2c1nccc2)CCC
    InChIKey: MZDYABXXPZNUCT-UHFFFAOYSA-N
    InChI:  InChI=1S/C27H38N6O2/c1-3-16-31(17-4-2)20-21-10-7-8-18-32(21)19-15-29-27(35)33-24-13-6-5-11-22(24)26(34)30-23-12-9-14-28-25(23)33/h5-6,9,11-14,21H,3-4,show more
    Synonyms: [³H]AF-DX 384
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  11. Ro15-4513
    IUPAC Name:  ethyl 12-azido-8-methyl-9-oxo-2,4,8-triazatricyclo[8.4.0.0^{2,6}]tetradeca-1(10),3,5,11,13-pentaene-5-carboxylate
    SMILES:  CCOC(=O)c1ncn2c1CN(C)C(=O)c1c2ccc(c1)N=[N+]=[N-]
    InChIKey: CFSOJZTUTOQNIA-UHFFFAOYSA-N
    InChI:  InChI=1S/C15H14N6O3/c1-3-24-15(23)13-12-7-20(2)14(22)10-6-9(18-19-16)4-5-11(10)21(12)8-17-13/h4-6,8H,3,7H2,1-2H3
    Synonyms: BRD-K82823076-001-01-8 | CS-0027980 | UNII-S5XGL82O5Y | [3H]Ro154513 | [3H]Ro15-4513 | Ro 154513 | Ro 15-4513 | 4H-Im...
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  12. R-L3
    IUPAC Name:  (3R)-5-(2-fluorophenyl)-3-(1H-indol-3-ylmethyl)-1-methyl-3H-1,4-benzodiazepin-2-one
    SMILES:  O=C1[C@H](N=C(c2c(N1C)cccc2)c1ccccc1F)Cc1c[nH]c2c1cccc2
    InChIKey: CGBANSGENFERAT-JOCHJYFZSA-N
    InChI:  InChI=1S/C25H20FN3O/c1-29-23-13-7-4-10-19(23)24(18-9-2-5-11-20(18)26)28-22(25(29)30)14-16-15-27-21-12-6-3-8-17(16)21/h2-13,15,22,27H,14H2,1H3/t22-/m1/show more
    Synonyms: GTPL2595 | L364373 | L-364373 | L-364,373 | R-L364,373 | 5-(2-FLUOROPHENYL)-1,3-DIHYDRO-3-(1H-INDOL-3-YLMETHYL)-1-MET...
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