ChemSpider 2D Image | Methyl N-[(4-{2-[(2-methyl-2-propanyl)amino]-2-oxoethyl}-1,4-diazepan-1-yl)acetyl]leucinate | C20H38N4O4

Methyl N-[(4-{2-[(2-methyl-2-propanyl)amino]-2-oxoethyl}-1,4-diazepan-1-yl)acetyl]leucinate

  • Molecular FormulaC20H38N4O4
  • Average mass398.540 Da
  • Monoisotopic mass398.289307 Da
  • ChemSpider ID22560403

More details:

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

Leucine, N-[2-[4-[2-[(1,1-dimethylethyl)amino]-2-oxoethyl]hexahydro-1H-1,4-diazepin-1-yl]acetyl]-, methyl ester [ACD/Index Name]
Methyl N-[(4-{2-[(2-methyl-2-propanyl)amino]-2-oxoethyl}-1,4-diazepan-1-yl)acetyl]leucinate [ACD/IUPAC Name]
Methyl-N-[(4-{2-[(2-methyl-2-propanyl)amino]-2-oxoethyl}-1,4-diazepan-1-yl)acetyl]leucinat [German] [ACD/IUPAC Name]
N-[2-(4-{2-[(2-Méthyl-2-propanyl)amino]-2-oxoéthyl}-1,4-diazépan-1-yl)acétyl]leucinate de méthyle [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 566.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.1±3.0 kJ/mol
Flash Point: 296.5±30.1 °C
Index of Refraction: 1.485
Molar Refractivity: 108.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 2.56
ACD/LogD (pH 5.5): 0.59
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 18.38
ACD/LogD (pH 7.4): 1.51
ACD/BCF (pH 7.4): 8.02
ACD/KOC (pH 7.4): 150.30
Polar Surface Area: 91 Å2
Polarizability: 43.1±0.5 10-24cm3
Surface Tension: 37.6±3.0 dyne/cm
Molar Volume: 379.2±3.0 cm3

Click to predict properties on the Chemicalize site


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