Cas no 887115-55-1 (3-iodo-1-(phenylsulfonyl)-1H-pyrrolo[2,3-c]pyridine)

3-iodo-1-(phenylsulfonyl)-1H-pyrrolo[2,3-c]pyridine structure
887115-55-1 structure
Product Name:3-iodo-1-(phenylsulfonyl)-1H-pyrrolo[2,3-c]pyridine
CAS No:887115-55-1
MF:C13H9IN2O2S
MW:384.192233800888
CID:2123166
PubChem ID:57600362
Update Time:2025-04-21

3-iodo-1-(phenylsulfonyl)-1H-pyrrolo[2,3-c]pyridine Chemical and Physical Properties

Names and Identifiers

    • 3-iodo-1-(phenylsulfonyl)-1H-pyrrolo[2,3-c]pyridine
    • 1-benzenesulfonyl-3-iodo-1H-pyrrolo[2,3-c]pyridine
    • SCHEMBL254249
    • DTXSID001222677
    • DA-01518
    • KNWORKBAWASJSW-UHFFFAOYSA-N
    • 887115-55-1
    • Inchi: 1S/C13H9IN2O2S/c14-12-9-16(13-8-15-7-6-11(12)13)19(17,18)10-4-2-1-3-5-10/h1-9H
    • InChI Key: KNWORKBAWASJSW-UHFFFAOYSA-N
    • SMILES: IC1=CN(C2C=NC=CC=21)S(C1C=CC=CC=1)(=O)=O

Computed Properties

  • Exact Mass: 383.94295Da
  • Monoisotopic Mass: 383.94295Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 2
  • Complexity: 417
  • 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: 2.8
  • Topological Polar Surface Area: 60.3?2
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