Found 1565 results

Search term: MF = 'C_{31}H_{42}N_{4}O_{3}'
ChemSpider 2D Image | N-Benzyl-5-[(cyclopentylcarbonyl)amino]-N-methyl-2-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]benzamide | C31H42N4O3

N-Benzyl-5-[(cyclopentylcarbonyl)amino]-N-methyl-2-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]benzamide

  • Molecular FormulaC31H42N4O3
  • Average mass518.690 Da
  • Monoisotopic mass518.325684 Da
  • ChemSpider ID22642800

More details:

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

Benzamide, 5-[(cyclopentylcarbonyl)amino]-2-[hexahydro-4-(3-methyl-1-oxobutyl)-1H-1,4-diazepin-1-yl]-N-methyl-N-(phenylmethyl)- [ACD/Index Name]
N-Benzyl-5-[(cyclopentylcarbonyl)amino]-N-methyl-2-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]benzamid [German] [ACD/IUPAC Name]
N-Benzyl-5-[(cyclopentylcarbonyl)amino]-N-methyl-2-[4-(3-methylbutanoyl)-1,4-diazepan-1-yl]benzamide [ACD/IUPAC Name]
N-Benzyl-5-[(cyclopentylcarbonyl)amino]-N-méthyl-2-[4-(3-méthylbutanoyl)-1,4-diazépan-1-yl]benzamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 775.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 112.9±3.0 kJ/mol
Flash Point: 422.8±32.9 °C
Index of Refraction: 1.594
Molar Refractivity: 151.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 3.45
ACD/LogD (pH 5.5): 3.53
ACD/BCF (pH 5.5): 243.98
ACD/KOC (pH 5.5): 1505.27
ACD/LogD (pH 7.4): 3.78
ACD/BCF (pH 7.4): 435.81
ACD/KOC (pH 7.4): 2688.85
Polar Surface Area: 73 Å2
Polarizability: 59.9±0.5 10-24cm3
Surface Tension: 51.8±3.0 dyne/cm
Molar Volume: 445.5±3.0 cm3

Click to predict properties on the Chemicalize site


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