ChemSpider 2D Image | N-{[2-(Isobutyrylamino)-6-oxo-3,6-dihydro-9H-purin-9-yl]acetyl}-N-(2-{[(4-methoxyphenyl)(diphenyl)methyl]amino}ethyl)glycine | C35H37N7O6

N-{[2-(Isobutyrylamino)-6-oxo-3,6-dihydro-9H-purin-9-yl]acetyl}-N-(2-{[(4-methoxyphenyl)(diphenyl)methyl]amino}ethyl)glycine

  • Molecular FormulaC35H37N7O6
  • Average mass651.712 Da
  • Monoisotopic mass651.280518 Da
  • ChemSpider ID9149521

More details:

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

Glycine, N-[2-[3,6-dihydro-2-[(2-methyl-1-oxopropyl)amino]-6-oxo-9H-purin-9-yl]acetyl]-N-[2-[[(4-methoxyphenyl)diphenylmethyl]amino]ethyl]- [ACD/Index Name]
N-{[2-(Isobutyrylamino)-6-oxo-3,6-dihydro-9H-purin-9-yl]acetyl}-N-(2-{[(4-methoxyphenyl)(diphenyl)methyl]amino}ethyl)glycin [German] [ACD/IUPAC Name]
N-{[2-(Isobutyrylamino)-6-oxo-3,6-dihydro-9H-purin-9-yl]acetyl}-N-(2-{[(4-methoxyphenyl)(diphenyl)methyl]amino}ethyl)glycine [ACD/IUPAC Name]
N-{2-[2-(Isobutyrylamino)-6-oxo-3,6-dihydro-9H-purin-9-yl]acétyl}-N-(2-{[(4-méthoxyphényl)(diphényl)méthyl]amino}éthyl)glycine [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.651
Molar Refractivity: 179.9±0.5 cm3
#H bond acceptors: 13
#H bond donors: 4
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 3.90
ACD/LogD (pH 5.5): 1.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.46
ACD/LogD (pH 7.4): 0.21
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 167 Å2
Polarizability: 71.3±0.5 10-24cm3
Surface Tension: 54.4±7.0 dyne/cm
Molar Volume: 492.8±7.0 cm3

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