ChemSpider 2D Image | HYDROXYPYRROLE-IMIDAZOLE-PYRROLE POLYAMIDE | C31H41N11O6

HYDROXYPYRROLE-IMIDAZOLE-PYRROLE POLYAMIDE

  • Molecular FormulaC31H41N11O6
  • Average mass663.727 Da
  • Monoisotopic mass663.324158 Da
  • ChemSpider ID21542367

More details:

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

1H-Imidazole-2-carboxamide, N-[5-[[[5-[[[5-[[[3-[[3-(dimethylamino)propyl]amino]-3-oxopropyl]amino]carbonyl]-1-methyl-1H-pyrrol-3-yl]amino]carbonyl]-4-hydroxy-1-methyl-1H-pyrrol-3-yl]amino]carbonyl]-1 -methyl-1H-pyrrol-3-yl]-1-methyl- [ACD/Index Name]
HYDROXYPYRROLE-IMIDAZOLE-PYRROLE POLYAMIDE
N-(5-{[5-({5-[(3-{[3-(Dimethylamino)propyl]amino}-3-oxopropyl)carbamoyl]-1-methyl-1H-pyrrol-3-yl}carbamoyl)-4-hydroxy-1-methyl-1H-pyrrol-3-yl]carbamoyl}-1-methyl-1H-pyrrol-3-yl)-1-methyl-1H-imidazol-2 -carboxamid [German] [ACD/IUPAC Name]
N-(5-{[5-({5-[(3-{[3-(Dimethylamino)propyl]amino}-3-oxopropyl)carbamoyl]-1-methyl-1H-pyrrol-3-yl}carbamoyl)-4-hydroxy-1-methyl-1H-pyrrol-3-yl]carbamoyl}-1-methyl-1H-pyrrol-3-yl)-1-methyl-1H-imidazole- 2-carboxamide [ACD/IUPAC Name]
N-(5-{[5-({5-[(3-{[3-(Diméthylamino)propyl]amino}-3-oxopropyl)carbamoyl]-1-méthyl-1H-pyrrol-3-yl}carbamoyl)-4-hydroxy-1-méthyl-1H-pyrrol-3-yl]carbamoyl}-1-méthyl-1H-pyrrol-3-yl)-1-méthyl-1H-imidazole- 2-carboxamide [French] [ACD/IUPAC Name]
HP2

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.666
Molar Refractivity: 177.3±0.5 cm3
#H bond acceptors: 17
#H bond donors: 6
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 3
ACD/LogP: -0.47
ACD/LogD (pH 5.5): -3.44
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.30
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 202 Å2
Polarizability: 70.3±0.5 10-24cm3
Surface Tension: 57.0±7.0 dyne/cm
Molar Volume: 476.9±7.0 cm3

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