ChemSpider 2D Image | N-(2-{(3,4-Dichlorobenzyl)[2-(1H-indol-3-yl)ethyl]amino}-2-oxoethyl)-N-isobutyl-3-nitrobenzamide | C30H30Cl2N4O4

N-(2-{(3,4-Dichlorobenzyl)[2-(1H-indol-3-yl)ethyl]amino}-2-oxoethyl)-N-isobutyl-3-nitrobenzamide

  • Molecular FormulaC30H30Cl2N4O4
  • Average mass581.490 Da
  • Monoisotopic mass580.164429 Da
  • ChemSpider ID3371772

More details:

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

Benzamide, N-[2-[[(3,4-dichlorophenyl)methyl][2-(1H-indol-3-yl)ethyl]amino]-2-oxoethyl]-N-(2-methylpropyl)-3-nitro- [ACD/Index Name]
N-(2-{(3,4-Dichlorbenzyl)[2-(1H-indol-3-yl)ethyl]amino}-2-oxoethyl)-N-isobutyl-3-nitrobenzamid [German] [ACD/IUPAC Name]
N-(2-{(3,4-Dichlorobenzyl)[2-(1H-indol-3-yl)ethyl]amino}-2-oxoethyl)-N-isobutyl-3-nitrobenzamide [ACD/IUPAC Name]
N-(2-{(3,4-Dichlorobenzyl)[2-(1H-indol-3-yl)éthyl]amino}-2-oxoéthyl)-N-isobutyl-3-nitrobenzamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 784.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 114.2±3.0 kJ/mol
Flash Point: 428.5±32.9 °C
Index of Refraction: 1.649
Molar Refractivity: 158.4±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 6.02
ACD/LogD (pH 5.5): 5.53
ACD/BCF (pH 5.5): 9407.14
ACD/KOC (pH 5.5): 24310.33
ACD/LogD (pH 7.4): 5.53
ACD/BCF (pH 7.4): 9407.14
ACD/KOC (pH 7.4): 24310.33
Polar Surface Area: 102 Å2
Polarizability: 62.8±0.5 10-24cm3
Surface Tension: 58.0±3.0 dyne/cm
Molar Volume: 434.6±3.0 cm3

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