ChemSpider 2D Image | 4-Methyl 1-(2-methyl-2-propanyl) 4-benzyl-2-(1-{[(3,5-difluorophenyl)acetyl]amino}ethyl)-4,5-dihydro-1H-imidazole-1,4-dicarboxylate | C27H31F2N3O5

4-Methyl 1-(2-methyl-2-propanyl) 4-benzyl-2-(1-{[(3,5-difluorophenyl)acetyl]amino}ethyl)-4,5-dihydro-1H-imidazole-1,4-dicarboxylate

  • Molecular FormulaC27H31F2N3O5
  • Average mass515.549 Da
  • Monoisotopic mass515.223206 Da
  • ChemSpider ID8567239

More details:

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

1H-Imidazole-1,4-dicarboxylic acid, 2-[1-[[2-(3,5-difluorophenyl)acetyl]amino]ethyl]-4,5-dihydro-4-(phenylmethyl)-, 1-(1,1-dimethylethyl) 4-methyl ester [ACD/Index Name]
4-Benzyl-2-(1-{[2-(3,5-difluorophényl)acétyl]amino}éthyl)-4,5-dihydro-1H-imidazole-1,4-dicarboxylate de 4-méthyle et de 1-(2-méthyl-2-propanyle) [French] [ACD/IUPAC Name]
4-Methyl 1-(2-methyl-2-propanyl) 4-benzyl-2-(1-{[(3,5-difluorophenyl)acetyl]amino}ethyl)-4,5-dihydro-1H-imidazole-1,4-dicarboxylate [ACD/IUPAC Name]
4-Methyl-1-(2-methyl-2-propanyl)-4-benzyl-2-(1-{[(3,5-difluorphenyl)acetyl]amino}ethyl)-4,5-dihydro-1H-imidazol-1,4-dicarboxylat [German] [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.557
Molar Refractivity: 134.6±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 3.42
ACD/LogD (pH 5.5): 3.82
ACD/BCF (pH 5.5): 473.68
ACD/KOC (pH 5.5): 2862.25
ACD/LogD (pH 7.4): 3.82
ACD/BCF (pH 7.4): 473.73
ACD/KOC (pH 7.4): 2862.51
Polar Surface Area: 97 Å2
Polarizability: 53.4±0.5 10-24cm3
Surface Tension: 40.3±7.0 dyne/cm
Molar Volume: 418.3±7.0 cm3

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