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-(methylimino)propyl]carbamoyl}-1-methyl-1H-pyrrol-3-yl)carbamoyl]-1-methyl-1H-pyrrol-3-yl}carbamoyl)-1-methyl-1H-pyrrol-3-yl]-3-[(2-bromoacryloyl)amino]-1-methyl-1H-pyraz ole-5-carboxamide | C30H35BrN12O5

N-[5-({5-[(5-{[(3Z)-3-Amino-3-(methylimino)propyl]carbamoyl}-1-methyl-1H-pyrrol-3-yl)carbamoyl]-1-methyl-1H-pyrrol-3-yl}carbamoyl)-1-methyl-1H-pyrrol-3-yl]-3-[(2-bromoacryloyl)amino]-1-methyl-1H-pyraz ole-5-carboxamide

  • Molecular FormulaC30H35BrN12O5
  • Average mass723.580 Da
  • Monoisotopic mass722.203674 Da
  • ChemSpider ID8050824

More details:

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

1H-Pyrazole-5-carboxamide, N-[5-[[[5-[[[5-[[[(3Z)-3-amino-3-(methylimino)propyl]amino]carbonyl]-1-methyl-1H-pyrrol-3-yl]amino]carbonyl]-1-methyl-1H-pyrrol-3-yl]amino]carbonyl]-1-methyl-1H-pyrrol-3-yl] -3-[(2-bromo-1-oxo-2-propen-1-yl)amino]-1-methyl- [ACD/Index Name]
N-[5-({5-[(5-{[(3Z)-3-Amino-3-(methylimino)propyl]carbamoyl}-1-methyl-1H-pyrrol-3-yl)carbamoyl]-1-methyl-1H-pyrrol-3-yl}carbamoyl)-1-methyl-1H-pyrrol-3-yl]-3-[(2-bromacryloyl)amino]-1-methyl-1H-pyrazo l-5-carboxamid [German] [ACD/IUPAC Name]
N-[5-({5-[(5-{[(3Z)-3-Amino-3-(methylimino)propyl]carbamoyl}-1-methyl-1H-pyrrol-3-yl)carbamoyl]-1-methyl-1H-pyrrol-3-yl}carbamoyl)-1-methyl-1H-pyrrol-3-yl]-3-[(2-bromoacryloyl)amino]-1-methyl-1H-pyraz ole-5-carboxamide [ACD/IUPAC Name]
N-[5-({5-[(5-{[(3Z)-3-Amino-3-(méthylimino)propyl]carbamoyl}-1-méthyl-1H-pyrrol-3-yl)carbamoyl]-1-méthyl-1H-pyrrol-3-yl}carbamoyl)-1-méthyl-1H-pyrrol-3-yl]-3-[(2-bromoacryloyl)amino]-1-méthyl-1H-pyraz ole-5-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.700
Molar Refractivity: 180.4±0.5 cm3
#H bond acceptors: 17
#H bond donors: 7
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: -1.80
ACD/LogD (pH 5.5): -2.35
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.35
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 216 Å2
Polarizability: 71.5±0.5 10-24cm3
Surface Tension: 60.6±7.0 dyne/cm
Molar Volume: 466.8±7.0 cm3

Click to predict properties on the Chemicalize site


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