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Diazepanes

Description:

Compounds containing a diazepane rings, which is a saturated seven-membered ring with 2 nitrogen atoms and five carbon atoms.
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Items 13-24 of 48

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  1. tert-butyl 7-oxo-3,6-diazabicyclo[3.2.2]nonane-3-carboxylate
      Grade & Purity: 
    • ≥97%
    Cas Number: 1784807-21-1        EC Number: 886-764-3        Compound CID:  84701993
    Formula:  C12H20N2O3        Molecular Weight: 240.3
    IUPAC Name:  tert-butyl 7-oxo-3,6-diazabicyclo[3.2.2]nonane-3-carboxylate
    SMILES:  CC(C)(C)OC(=O)N1CC2CCC(C1)NC2=O
    InChIKey: PDTLUVMGYJWBHZ-UHFFFAOYSA-N
    InChI:  InChI=1S/C12H20N2O3/c1-12(2,3)17-11(16)14-6-8-4-5-9(7-14)13-10(8)15/h8-9H,4-7H2,1-3H3,(H,13,15)
    Synonyms: 3-Boc-7-oxo-3,6-diazabicyclo[3.2.2]nonane | CS-0036695 | tert-Butyl 7-oxo-3,6-diazabicyclo[3.2.2]nonane-3-carboxylate...
  2. tert-butyl 6-(trifluoromethyl)-1,4-diazepane-1-carboxylate
      Grade & Purity: 
    • ≥97%
    Cas Number: 1273564-15-0        Compound CID:  71305790
    Formula:  C11H19F3N2O2        Molecular Weight: 268.28
    IUPAC Name:  tert-butyl 6-(trifluoromethyl)-1,4-diazepane-1-carboxylate
    SMILES:  CC(C)(C)OC(=O)N1CCNCC(C1)C(F)(F)F
    InChIKey: CWQGBNGEHCBHCG-UHFFFAOYSA-N
    InChI:  InChI=1S/C11H19F3N2O2/c1-10(2,3)18-9(17)16-5-4-15-6-8(7-16)11(12,13)14/h8,15H,4-7H2,1-3H3
    Synonyms: 1273564-15-0 | tert-Butyl 6-(trifluoromethyl)-1,4-diazepane-1-carboxylate | 6-TRIFLUOROMETHYL-[1,4]DIAZEPANE-1-CARBOX...
  3. tert-butyl 6,6-difluoro-1,4-diazepane-1-carboxylate
      Grade & Purity: 
    • ≥97%
    Cas Number: 1166820-07-0        EC Number: 839-527-3        Compound CID:  56924440
    Formula:  C10H18N2O2F2        Molecular Weight: 236.25
    IUPAC Name:  tert-butyl 6,6-difluoro-1,4-diazepane-1-carboxylate
    SMILES:  CC(C)(C)OC(=O)N1CCNCC(C1)(F)F
    InChIKey: QELRSCXQUXCUED-UHFFFAOYSA-N
    InChI:  InChI=1S/C10H18F2N2O2/c1-9(2,3)16-8(15)14-5-4-13-6-10(11,12)7-14/h13H,4-7H2,1-3H3
    Synonyms: EN300-1654216 | SCHEMBL2264531 | CS-0112801 | DTXSID50718845 | SY014262 | tert-butyl 6,6-difluoro-1,4-diazepane-1-car...
  4. tert-butyl 3-iodo-4,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepine-5-carboxylate
      Grade & Purity: 
    • ≥97%
    Cas Number: 1823263-02-0        Compound CID:  130058758
    Formula:  C12H18N3O2I        Molecular Weight: 363.19
    IUPAC Name:  tert-butyl 3-iodo-4,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepine-5-carboxylate
    SMILES:  CC(C)(C)OC(=O)N1CCCN2C(=C(C=N2)I)C1
    InChIKey: KARJAMVBTXLMDA-UHFFFAOYSA-N
    InChI:  InChI=1S/C12H18IN3O2/c1-12(2,3)18-11(17)15-5-4-6-16-10(8-15)9(13)7-14-16/h7H,4-6,8H2,1-3H3
    Synonyms: 1823263-02-0 | tert-butyl 3-iodo-4,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepine-5-carboxylate | tert-butyl 3-iodo-4H...
  5. tert-butyl (7S)-7-methyl-1,4-diazepane-1-carboxylate
      Grade & Purity: 
    • ≥97%
    Cas Number: 1638744-15-6
    Formula:  C11H22N2O2        Molecular Weight: 214.3
    IUPAC Name:  tert-butyl (7S)-7-methyl-1,4-diazepane-1-carboxylate
    SMILES:  CC1CCNCCN1C(=O)OC(C)(C)C
    InChIKey: DUYDMHWWVXLFDB-VIFPVBQESA-N
    InChI:  InChI=1S/C11H22N2O2/c1-9-5-6-12-7-8-13(9)10(14)15-11(2,3)4/h9,12H,5-8H2,1-4H3/t9-/m0/s1
    Synonyms: 1638744-15-6 | (S)-4-Boc-5-methyl-1,4-diazepane | tert-Butyl (7S)-7-methyl-1,4-diazepane-1-carboxylate | (S)-tert-But...
  6. tert-butyl (5S)-5-methyl-1,4-diazepane-1-carboxylate
      Grade & Purity: 
    • ≥97%
    Cas Number: 1260619-37-1        Compound CID:  52221681
    Formula:  C11H22N2O2        Molecular Weight: 214.31
    IUPAC Name:  tert-butyl (5S)-5-methyl-1,4-diazepane-1-carboxylate
    SMILES:  CC1CCN(CCN1)C(=O)OC(C)(C)C
    InChIKey: SVMXIQUBNSPVCB-VIFPVBQESA-N
    InChI:  InChI=1S/C11H22N2O2/c1-9-5-7-13(8-6-12-9)10(14)15-11(2,3)4/h9,12H,5-8H2,1-4H3/t9-/m0/s1
    Synonyms: (5S)-1-Boc-5-methyl-1,4-diazepane | 1260619-37-1 | t-Butyl (5S)-5-methyl-1,4-diazepane-1-carboxylate | AB70728 | (S)-...
  7. tert-butyl (5R)-5-methyl-1,4-diazepane-1-carboxylate
      Grade & Purity: 
    • ≥97%
    Cas Number: 1260619-38-2        Compound CID:  52221678
    Formula:  C11H22N2O2        Molecular Weight: 214.3
    IUPAC Name:  tert-butyl (5R)-5-methyl-1,4-diazepane-1-carboxylate
    SMILES:  CC1CCN(CCN1)C(=O)OC(C)(C)C
    InChIKey: SVMXIQUBNSPVCB-SECBINFHSA-N
    InChI:  InChI=1S/C11H22N2O2/c1-9-5-7-13(8-6-12-9)10(14)15-11(2,3)4/h9,12H,5-8H2,1-4H3/t9-/m1/s1
    Synonyms: CS-0055524 | AS-80127 | DTXSID201125578 | SCHEMBL17784898 | A908755 | MFCD18250107 | (R)-tert-Butyl 5-methyl-1,4-diaz...
  8. tert-butyl (3R)-3-methyl-1,4-diazepane-1-carboxylate
      Grade & Purity: 
    • ≥97%
    Cas Number: 223644-10-8        EC Number: 867-393-6
    Formula:  C11H22N2O2        Molecular Weight: 214.31
    IUPAC Name:  tert-butyl (3R)-3-methyl-1,4-diazepane-1-carboxylate
    SMILES:  CC1CN(CCCN1)C(=O)OC(C)(C)C
    InChIKey: GDTFCUXOVITPHU-SECBINFHSA-N
    InChI:  InChI=1S/C11H22N2O2/c1-9-8-13(7-5-6-12-9)10(14)15-11(2,3)4/h9,12H,5-8H2,1-4H3/t9-/m1/s1
    Synonyms: 223644-10-8 | (R)-1-BOC-3-METHYL-[1,4]DIAZEPANE | (R)-TERT-BUTYL 3-METHYL-1,4-DIAZEPANE-1-CARBOXYLATE | TERT-BUTYL (3...
  9. tert-butyl (1R,5R)-2,6-diazabicyclo[3.2.0]heptane-6-carboxylate
      Grade & Purity: 
    • ≥97%
    Cas Number: 1932364-12-9
    Formula:  C10H18N2O2        Molecular Weight: 198.26
    IUPAC Name:  tert-butyl (1R,5R)-2,6-diazabicyclo[3.2.0]heptane-6-carboxylate
    SMILES:  CC(C)(C)OC(=O)N1CC2C1CCN2
    InChIKey: BDVMAANWMDTLFP-HTQZYQBOSA-N
    InChI:  InChI=1S/C10H18N2O2/c1-10(2,3)14-9(13)12-6-7-8(12)4-5-11-7/h7-8,11H,4-6H2,1-3H3/t7-,8-/m1/s1
    Synonyms: SCHEMBL22587052 | F86178 | (1R,5R)-TERT-BUTYL 2,6-DIAZABICYCLO[3.2.0]HEPTANE-6-CARBOXYLATE | 1932364-12-9
  10. 6,6-difluoro-1-methyl-1,4-diazepane dihydrochloride
      Grade & Purity: 
    • ≥97%
    Cas Number: 2227206-69-9        Compound CID:  134830357
    IUPAC Name:  6,6-difluoro-1-methyl-1,4-diazepane;dihydrochloride
    SMILES:  CN1CCNCC(C1)(F)F.Cl.Cl
    InChIKey: KBBDFGYRHCSEGL-UHFFFAOYSA-N
    InChI:  InChI=1S/C6H12F2N2.2ClH/c1-10-3-2-9-4-6(7,8)5-10;;/h9H,2-5H2,1H3;2*1H
    Synonyms: 6,6-difluoro-1-methyl-1,4-diazepane dihydrochloride | 2227206-69-9 | 6,6-difluoro-1-methyl-1,4-diazepane | dihydrochl...
  11. 6,6-difluoro-1,4-diazepane;dihydrobromide
      Grade & Purity: 
    • ≥97%
    Cas Number: 529509-60-2        Compound CID:  135396087
    IUPAC Name:  6,6-difluoro-1,4-diazepane;dihydrobromide
    SMILES:  C1CNCC(CN1)(F)F.Br.Br
    InChIKey: RYDVDHYLPRRPFG-UHFFFAOYSA-N
    InChI:  InChI=1S/C5H10F2N2.2BrH/c6-5(7)3-8-1-2-9-4-5;;/h8-9H,1-4H2;2*1H
    Synonyms: 6,6-difluoro-1,4-diazepane dihydrobromide | 529509-60-2 | MFCD30803879 | 6,6-difluoro-1,4-diazepanedihydrobromide | B...
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