ChemSpider 2D Image | 1-Butyl-N-[4-({2-[(2-methyl-2-propanyl)carbamoyl]phenyl}carbamoyl)phenyl]-5-oxo-3-pyrrolidinecarboxamide | C27H34N4O4

1-Butyl-N-[4-({2-[(2-methyl-2-propanyl)carbamoyl]phenyl}carbamoyl)phenyl]-5-oxo-3-pyrrolidinecarboxamide

  • Molecular FormulaC27H34N4O4
  • Average mass478.583 Da
  • Monoisotopic mass478.257996 Da
  • ChemSpider ID21586219

More details:

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

1-Butyl-N-[4-({2-[(2-methyl-2-propanyl)carbamoyl]phenyl}carbamoyl)phenyl]-5-oxo-3-pyrrolidincarboxamid [German] [ACD/IUPAC Name]
1-Butyl-N-[4-({2-[(2-methyl-2-propanyl)carbamoyl]phenyl}carbamoyl)phenyl]-5-oxo-3-pyrrolidinecarboxamide [ACD/IUPAC Name]
1-Butyl-N-[4-({2-[(2-méthyl-2-propanyl)carbamoyl]phényl}carbamoyl)phényl]-5-oxo-3-pyrrolidinecarboxamide [French] [ACD/IUPAC Name]
3-Pyrrolidinecarboxamide, 1-butyl-N-[4-[[[2-[[(1,1-dimethylethyl)amino]carbonyl]phenyl]amino]carbonyl]phenyl]-5-oxo- [ACD/Index Name]
1-Butyl-5-oxo-pyrrolidine-3-carboxylic acid [4-(2-tert-butylcarbamoyl-phenylcarbamoyl)-phenyl]-amide
1-butyl-N-(4-{[2-(tert-butylcarbamoyl)phenyl]carbamoyl}phenyl)-5-oxopyrrolidine-3-carboxamide
1-butyl-N-{4-[({2-[(tert-butylamino)carbonyl]phenyl}amino)carbonyl]phenyl}-5-oxopyrrolidine-3-carboxamide

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

Density: 1.2±0.1 g/cm3
Boiling Point: 680.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.8±3.0 kJ/mol
Flash Point: 365.1±31.5 °C
Index of Refraction: 1.609
Molar Refractivity: 136.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.73
ACD/LogD (pH 5.5): 3.35
ACD/BCF (pH 5.5): 206.49
ACD/KOC (pH 5.5): 1579.82
ACD/LogD (pH 7.4): 3.35
ACD/BCF (pH 7.4): 206.49
ACD/KOC (pH 7.4): 1579.82
Polar Surface Area: 108 Å2
Polarizability: 54.1±0.5 10-24cm3
Surface Tension: 54.6±3.0 dyne/cm
Molar Volume: 394.2±3.0 cm3

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