ChemSpider 2D Image | 5-Amino-N-{4-[(3-cyclohexylpropyl)carbamoyl]benzyl}-1-phenyl-1H-pyrazole-4-carboxamide | C27H33N5O2

5-Amino-N-{4-[(3-cyclohexylpropyl)carbamoyl]benzyl}-1-phenyl-1H-pyrazole-4-carboxamide

  • Molecular FormulaC27H33N5O2
  • Average mass459.583 Da
  • Monoisotopic mass459.263428 Da
  • ChemSpider ID88296694

More details:

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

1H-Pyrazole-4-carboxamide, 5-amino-N-[[4-[[(3-cyclohexylpropyl)amino]carbonyl]phenyl]methyl]-1-phenyl- [ACD/Index Name]
5-Amino-N-{4-[(3-cyclohexylpropyl)carbamoyl]benzyl}-1-phenyl-1H-pyrazol-4-carboxamid [German] [ACD/IUPAC Name]
5-Amino-N-{4-[(3-cyclohexylpropyl)carbamoyl]benzyl}-1-phenyl-1H-pyrazole-4-carboxamide [ACD/IUPAC Name]
5-Amino-N-{4-[(3-cyclohexylpropyl)carbamoyl]benzyl}-1-phényl-1H-pyrazole-4-carboxamide [French] [ACD/IUPAC Name]
2413286-32-3 [RN]
5-Amino-N-(4-((3-cyclohexylpropyl)carbamoyl)benzyl)-1-phenyl-1H-pyrazole-4-carboxamide
5-amino-N-[[4-(3-cyclohexylpropylcarbamoyl)phenyl]methyl]-1-phenylpyrazole-4-carboxamide
Chembl4436748
SR 318
SR318
More...

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

Density: 1.2±0.1 g/cm3
Boiling Point: 732.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.8±3.0 kJ/mol
Flash Point: 396.5±32.9 °C
Index of Refraction: 1.644
Molar Refractivity: 133.5±0.5 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 5.99
ACD/LogD (pH 5.5): 4.40
ACD/BCF (pH 5.5): 1297.70
ACD/KOC (pH 5.5): 5888.51
ACD/LogD (pH 7.4): 4.40
ACD/BCF (pH 7.4): 1297.73
ACD/KOC (pH 7.4): 5888.65
Polar Surface Area: 102 Å2
Polarizability: 52.9±0.5 10-24cm3
Surface Tension: 51.7±7.0 dyne/cm
Molar Volume: 369.0±7.0 cm3

Click to predict properties on the Chemicalize site


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