ChemSpider 2D Image | N-[3-(2-Amino-1H-imidazol-4-yl)propyl]-4,5-dibromo-1-methyl-1H-pyrrole-2-carboxamide | C12H15Br2N5O

N-[3-(2-Amino-1H-imidazol-4-yl)propyl]-4,5-dibromo-1-methyl-1H-pyrrole-2-carboxamide

  • Molecular FormulaC12H15Br2N5O
  • Average mass405.088 Da
  • Monoisotopic mass402.964325 Da
  • ChemSpider ID24715749

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1H-Pyrrole-2-carboxamide, N-[3-(2-amino-1H-imidazol-4-yl)propyl]-4,5-dibromo-1-methyl- [ACD/Index Name]
N-[3-(2-Amino-1H-imidazol-4-yl)propyl]-4,5-dibrom-1-methyl-1H-pyrrol-2-carboxamid [German] [ACD/IUPAC Name]
N-[3-(2-Amino-1H-imidazol-4-yl)propyl]-4,5-dibromo-1-methyl-1H-pyrrole-2-carboxamide [ACD/IUPAC Name]
N-[3-(2-Amino-1H-imidazol-4-yl)propyl]-4,5-dibromo-1-méthyl-1H-pyrrole-2-carboxamide [French] [ACD/IUPAC Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL513853/

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.9±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.718
Molar Refractivity: 83.6±0.5 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.64
ACD/LogD (pH 5.5): -0.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.57
ACD/LogD (pH 7.4): 0.70
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 9.85
Polar Surface Area: 89 Å2
Polarizability: 33.1±0.5 10-24cm3
Surface Tension: 61.5±7.0 dyne/cm
Molar Volume: 212.1±7.0 cm3

Click to predict properties on the Chemicalize site


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