ChemSpider 2D Image | N-(4-Isopropylphenyl)-1-[(4-isopropylphenyl)amino]-3-oxo-2-propyl-5-isoindolinecarboxamide | C30H35N3O2

N-(4-Isopropylphenyl)-1-[(4-isopropylphenyl)amino]-3-oxo-2-propyl-5-isoindolinecarboxamide

  • Molecular FormulaC30H35N3O2
  • Average mass469.618 Da
  • Monoisotopic mass469.272919 Da
  • ChemSpider ID22464522

More details:

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

1H-Isoindole-5-carboxamide, 2,3-dihydro-N-[4-(1-methylethyl)phenyl]-1-[[4-(1-methylethyl)phenyl]amino]-3-oxo-2-propyl- [ACD/Index Name]
N-(4-Isopropylphenyl)-1-[(4-isopropylphenyl)amino]-3-oxo-2-propyl-5-isoindolincarboxamid [German] [ACD/IUPAC Name]
N-(4-Isopropylphenyl)-1-[(4-isopropylphenyl)amino]-3-oxo-2-propyl-5-isoindolinecarboxamide [ACD/IUPAC Name]
N-(4-Isopropylphényl)-1-[(4-isopropylphényl)amino]-3-oxo-2-propyl-5-isoindolinecarboxamide [French] [ACD/IUPAC Name]
N-(4-ISOPROPYLPHENYL)-1-[(4-ISOPROPYLPHENYL)AMINO]-3-OXO-2-PROPYL-1H-ISOINDOLE-5-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: 593.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.4±3.0 kJ/mol
Flash Point: 312.5±30.1 °C
Index of Refraction: 1.629
Molar Refractivity: 143.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.16
ACD/LogD (pH 5.5): 5.36
ACD/BCF (pH 5.5): 7025.78
ACD/KOC (pH 5.5): 19725.57
ACD/LogD (pH 7.4): 5.36
ACD/BCF (pH 7.4): 7027.23
ACD/KOC (pH 7.4): 19729.62
Polar Surface Area: 61 Å2
Polarizability: 56.9±0.5 10-24cm3
Surface Tension: 51.5±3.0 dyne/cm
Molar Volume: 404.1±3.0 cm3

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