ChemSpider 2D Image | tert-Butyl (2-{[2-(benzylamino)-1-(3,4-dimethoxyphenyl)-2-oxoethyl][(5-methyl-2-furyl)methyl]amino}-2-oxoethyl)carbamate | C30H37N3O7

tert-Butyl (2-{[2-(benzylamino)-1-(3,4-dimethoxyphenyl)-2-oxoethyl][(5-methyl-2-furyl)methyl]amino}-2-oxoethyl)carbamate

  • Molecular FormulaC30H37N3O7
  • Average mass551.631 Da
  • Monoisotopic mass551.263123 Da
  • ChemSpider ID10481870

More details:

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

(2-{[2-(Benzylamino)-1-(3,4-diméthoxyphényl)-2-oxoéthyl][(5-méthyl-2-furyl)méthyl]amino}-2-oxoéthyl)carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl (2-{[2-(benzylamino)-1-(3,4-dimethoxyphenyl)-2-oxoethyl][(5-methyl-2-furyl)methyl]amino}-2-oxoethyl)carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(2-{[2-(benzylamino)-1-(3,4-dimethoxyphenyl)-2-oxoethyl][(5-methyl-2-furyl)methyl]amino}-2-oxoethyl)carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[2-[[1-(3,4-dimethoxyphenyl)-2-oxo-2-[(phenylmethyl)amino]ethyl][(5-methyl-2-furanyl)methyl]amino]-2-oxoethyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
tert-Butyl (2-{[2-(benzylamino)-1-(3,4-dimethoxyphenyl)-2-oxoethyl][(5-methyl-2-furyl)methyl]amino}-2-oxoethyl)carbamate
tert-butyl (2-{[2-(benzylamino)-1-(3,4-dimethoxyphenyl)-2-oxoethyl][(5-methylfuran-2-yl)methyl]amino}-2-oxoethyl)carbamate
Ugi product 64C (UC)

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

Density: 1.2±0.1 g/cm3
Boiling Point: 756.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 110.2±3.0 kJ/mol
Flash Point: 411.2±32.9 °C
Index of Refraction: 1.560
Molar Refractivity: 149.7±0.3 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 4.63
ACD/LogD (pH 5.5): 3.99
ACD/BCF (pH 5.5): 631.83
ACD/KOC (pH 5.5): 3517.81
ACD/LogD (pH 7.4): 3.99
ACD/BCF (pH 7.4): 631.68
ACD/KOC (pH 7.4): 3516.95
Polar Surface Area: 119 Å2
Polarizability: 59.3±0.5 10-24cm3
Surface Tension: 45.5±3.0 dyne/cm
Molar Volume: 462.7±3.0 cm3

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