ChemSpider 2D Image | 2-Methyl-2-propanyl N-(4-chlorophenyl)-N-({3-[(N-{[(3-cyanobenzyl)oxy]carbonyl}-N-methylglycyl)amino]phenyl}sulfonyl)glycinate | C30H31ClN4O7S

2-Methyl-2-propanyl N-(4-chlorophenyl)-N-({3-[(N-{[(3-cyanobenzyl)oxy]carbonyl}-N-methylglycyl)amino]phenyl}sulfonyl)glycinate

  • Molecular FormulaC30H31ClN4O7S
  • Average mass627.108 Da
  • Monoisotopic mass626.160217 Da
  • ChemSpider ID9781735

More details:

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

2-Methyl-2-propanyl N-(4-chlorophenyl)-N-({3-[(N-{[(3-cyanobenzyl)oxy]carbonyl}-N-methylglycyl)amino]phenyl}sulfonyl)glycinate [ACD/IUPAC Name]
2-Methyl-2-propanyl-N-(4-chlorphenyl)-N-({3-[(N-{[(3-cyanbenzyl)oxy]carbonyl}-N-methylglycyl)amino]phenyl}sulfonyl)glycinat [German] [ACD/IUPAC Name]
Glycine, N-(4-chlorophenyl)-N-[[3-[[2-[[[(3-cyanophenyl)methoxy]carbonyl]methylamino]acetyl]amino]phenyl]sulfonyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
N-(4-Chlorophényl)-N-({3-[(N-{[(3-cyanobenzyl)oxy]carbonyl}-N-méthylglycyl)amino]phényl}sulfonyl)glycinate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.633
Molar Refractivity: 160.6±0.4 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 4.92
ACD/LogD (pH 5.5): 4.80
ACD/BCF (pH 5.5): 2597.33
ACD/KOC (pH 5.5): 9676.40
ACD/LogD (pH 7.4): 4.80
ACD/BCF (pH 7.4): 2597.31
ACD/KOC (pH 7.4): 9676.31
Polar Surface Area: 154 Å2
Polarizability: 63.7±0.5 10-24cm3
Surface Tension: 67.4±5.0 dyne/cm
Molar Volume: 449.6±5.0 cm3

Click to predict properties on the Chemicalize site


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