Cas no 1421517-98-7 (1H-Pyrrolo[2,3-c]pyridine, 4-methoxy-1-(phenylsulfonyl)-, 6-oxide)

1H-Pyrrolo[2,3-c]pyridine, 4-methoxy-1-(phenylsulfonyl)-, 6-oxide structure
1421517-98-7 structure
Product Name:1H-Pyrrolo[2,3-c]pyridine, 4-methoxy-1-(phenylsulfonyl)-, 6-oxide
CAS No:1421517-98-7
MF:C14H12N2O4S
MW:304.321082115173
CID:6635558
PubChem ID:132028840
Update Time:2024-01-14

1H-Pyrrolo[2,3-c]pyridine, 4-methoxy-1-(phenylsulfonyl)-, 6-oxide Chemical and Physical Properties

Names and Identifiers

    • 1H-Pyrrolo[2,3-c]pyridine, 4-methoxy-1-(phenylsulfonyl)-, 6-oxide
    • SCHEMBL19484960
    • 1421517-98-7
    • C92540
    • 4-METHOXY-1-(PHENYLSULFONYL)-1H-PYRROLO[2,3-C]PYRIDINE 6-OXIDE
    • Inchi: 1S/C14H12N2O4S/c1-20-14-10-15(17)9-13-12(14)7-8-16(13)21(18,19)11-5-3-2-4-6-11/h2-10H,1H3
    • InChI Key: HCOGMWAGOCWIJK-UHFFFAOYSA-N
    • SMILES: C1[N+]([O-])=CC(OC)=C2C=CN(S(C3=CC=CC=C3)(=O)=O)C=12

Computed Properties

  • Exact Mass: 304.05177804g/mol
  • Monoisotopic Mass: 304.05177804g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 3
  • Complexity: 458
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.1
  • Topological Polar Surface Area: 82.1?2
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