Found 3 results

Search term: MF = 'C_{30}H_{35}BrN_{12}O_{5}'
ChemSpider 2D Image | N-[5-({5-[(5-{[(3Z)-3-Amino-3-iminopropyl]carbamoyl}-1-methyl-1H-pyrrol-3-yl)carbamoyl]-1-methyl-1H-pyrrol-3-yl}carbamoyl)-1-methyl-1H-pyrrol-3-yl]-4-[(3-bromo-3-butenoyl)amino]-1-methyl-1H-imidazole- 2-carboxamide | C30H35BrN12O5

N-[5-({5-[(5-{[(3Z)-3-Amino-3-iminopropyl]carbamoyl}-1-methyl-1H-pyrrol-3-yl)carbamoyl]-1-methyl-1H-pyrrol-3-yl}carbamoyl)-1-methyl-1H-pyrrol-3-yl]-4-[(3-bromo-3-butenoyl)amino]-1-methyl-1H-imidazole- 2-carboxamide

  • Molecular FormulaC30H35BrN12O5
  • Average mass723.580 Da
  • Monoisotopic mass722.203674 Da
  • ChemSpider ID8459188

More details:

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

1H-Imidazole-2-carboxamide, N-[5-[[[5-[[[5-[[[(3Z)-3-amino-3-iminopropyl]amino]carbonyl]-1-methyl-1H-pyrrol-3-yl]amino]carbonyl]-1-methyl-1H-pyrrol-3-yl]amino]carbonyl]-1-methyl-1H-pyrrol-3-yl]-4-[(3- bromo-1-oxo-3-buten-1-yl)amino]-1-methyl- [ACD/Index Name]
N-[5-({5-[(5-{[(3Z)-3-Amino-3-iminopropyl]carbamoyl}-1-methyl-1H-pyrrol-3-yl)carbamoyl]-1-methyl-1H-pyrrol-3-yl}carbamoyl)-1-methyl-1H-pyrrol-3-yl]-4-[(3-brom-3-butenoyl)amino]-1-methyl-1H-imidazol-2- carboxamid [German] [ACD/IUPAC Name]
N-[5-({5-[(5-{[(3Z)-3-Amino-3-iminopropyl]carbamoyl}-1-methyl-1H-pyrrol-3-yl)carbamoyl]-1-methyl-1H-pyrrol-3-yl}carbamoyl)-1-methyl-1H-pyrrol-3-yl]-4-[(3-bromo-3-butenoyl)amino]-1-methyl-1H-imidazole- 2-carboxamide [ACD/IUPAC Name]
N-[5-({5-[(5-{[(3Z)-3-Amino-3-iminopropyl]carbamoyl}-1-méthyl-1H-pyrrol-3-yl)carbamoyl]-1-méthyl-1H-pyrrol-3-yl}carbamoyl)-1-méthyl-1H-pyrrol-3-yl]-4-[(3-bromo-3-butenoyl)amino]-1-méthyl-1H-imidazole- 2-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.709
Molar Refractivity: 179.5±0.5 cm3
#H bond acceptors: 17
#H bond donors: 8
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 3
ACD/LogP: -1.66
ACD/LogD (pH 5.5): -2.37
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.36
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 228 Å2
Polarizability: 71.2±0.5 10-24cm3
Surface Tension: 63.4±7.0 dyne/cm
Molar Volume: 459.7±7.0 cm3

Click to predict properties on the Chemicalize site


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