Cas no 34649-22-4 (1H-Pyrrole-2-carboxamide,N-[(2E)-3-(2-amino-1H-imidazol-4-yl)-2-propenyl]-4,5-dibromo-)

1H-Pyrrole-2-carboxamide,N-[(2E)-3-(2-amino-1H-imidazol-4-yl)-2-propenyl]-4,5-dibromo- structure
34649-22-4 structure
Product Name:1H-Pyrrole-2-carboxamide,N-[(2E)-3-(2-amino-1H-imidazol-4-yl)-2-propenyl]-4,5-dibromo-
CAS No:34649-22-4
MF:C11H11Br2N5O
MW:389.045939683914
CID:309267
PubChem ID:6312649
Update Time:2025-04-19

1H-Pyrrole-2-carboxamide,N-[(2E)-3-(2-amino-1H-imidazol-4-yl)-2-propenyl]-4,5-dibromo- Chemical and Physical Properties

Names and Identifiers

    • 1H-Pyrrole-2-carboxamide,N-[(2E)-3-(2-amino-1H-imidazol-4-yl)-2-propenyl]-4,5-dibromo-
    • 1H-pyrrole-2-carboxamide, N-[(2E)-3-(2-amino-1H-imidazol-5-yl)-2-propen-1-yl]-4,5-dibromo-
    • N-[(E)-3-(2-amino-1H-imidazol-5-yl)prop-2-enyl]-4,5-dibromo-1H-pyrrole-2-carboxamide
    • OROIDIN [MI]
    • 1H-Pyrrole-2-carboxamide, N-[(2E)-3-(2-amino-1H-imidazol-5-yl)-2-propenyl]-4,5-dibromo-
    • 4,5-Dibromo-1H-pyrrole-2-carboxylic acid [3-(2-amino-3H-imidazol-4-yl)-allyl]-amide
    • PF75E92XKM
    • CHEMBL397591
    • Q15425298
    • DTXSID001020635
    • Oroidin
    • SMR001216083
    • SCHEMBL12597862
    • N-[(E)-3-(2-amino-1H-imidazol-5-yl)allyl]-4,5-dibromo-1H-pyrrole-2-carboxamide
    • CHEBI:70037
    • BDBM50220547
    • oroidin base
    • 1H-PYRROLE-2-CARBOXAMIDE, N-((2E)-3-(2-AMINO-1H-IMIDAZOL-4-YL)-2-PROPENYL)-4,5-DIBROMO-
    • 4,5-Dibromo-1H-pyrrole-2-carboxylic acid [3-(2-amino-1H-imidazol-4-yl)-allyl]-amide
    • 34649-22-4
    • Oroidine
    • UNII-PF75E92XKM
    • 1H-Pyrrole-2-carboxamide, N-(3-(2-amino-1H-imidazol-4-yl)-2-propenyl)-4,5-dibromo-, (E)-
    • MLS001250229
    • 7-(15)N-oroidin
    • (E)-N-(3-(2-Amino-1H-imidazol-5-yl)allyl)-4,5-dibromo-1H-pyrrole-2-carboxamide
    • N-((E)-3-(2-amino-1H-imidazol-5-yl)prop-2-enyl)-4,5-dibromo-1H-pyrrole-2-carboxamide
    • Inchi： 1S/C11H11Br2N5O/c12-7-4-8(18-9(7)13)10(19)15-3-1-2-6-5-16-11(14)17-6/h1-2,4-5,18H,3H2,(H,15,19)(H3,14,16,17)/b2-1+
    • InChI Key： QKJAXHBFQSBDAR-OWOJBTEDSA-N
    • SMILES： BrC1=C(C=C(C(NC/C=C/C2=CN=C(N)N2)=O)N1)Br

Computed Properties

  • Exact Mass: 386.93313
  • Monoisotopic Mass: 386.93304g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 4
  • Complexity: 354
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2
  • Topological Polar Surface Area: 99.6?2

Experimental Properties

  • Density: 1.948
  • Boiling Point: °Cat760mmHg
  • Flash Point: °C
  • Refractive Index: 1.756
  • PSA: 99.59

1H-Pyrrole-2-carboxamide,N-[(2E)-3-(2-amino-1H-imidazol-4-yl)-2-propenyl]-4,5-dibromo- Related Literature

Related Categories

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