ChemSpider 2D Image | 2-Methyl-2-propanyl {1-[5-({2-[(3-chloro-2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-oxadiazol-2-yl]-2-(1H-indol-3-yl)ethyl}carbamate | C26H28ClN5O4S

2-Methyl-2-propanyl {1-[5-({2-[(3-chloro-2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-oxadiazol-2-yl]-2-(1H-indol-3-yl)ethyl}carbamate

  • Molecular FormulaC26H28ClN5O4S
  • Average mass542.050 Da
  • Monoisotopic mass541.155029 Da
  • ChemSpider ID3516096

More details:

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

{1-[5-({2-[(3-Chloro-2-méthylphényl)amino]-2-oxoéthyl}sulfanyl)-1,3,4-oxadiazol-2-yl]-2-(1H-indol-3-yl)éthyl}carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl {1-[5-({2-[(3-chloro-2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-oxadiazol-2-yl]-2-(1H-indol-3-yl)ethyl}carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-{1-[5-({2-[(3-chlor-2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-oxadiazol-2-yl]-2-(1H-indol-3-yl)ethyl}carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[1-[5-[[2-[(3-chloro-2-methylphenyl)amino]-2-oxoethyl]thio]-1,3,4-oxadiazol-2-yl]-2-(1H-indol-3-yl)ethyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
tert-butyl {1-[5-({2-[(3-chloro-2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-oxadiazol-2-yl]-2-(1H-indol-3-yl)ethyl}carbamate

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: 1.655
Molar Refractivity: 144.1±0.4 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.40
ACD/LogD (pH 5.5): 5.11
ACD/BCF (pH 5.5): 4521.83
ACD/KOC (pH 5.5): 14390.13
ACD/LogD (pH 7.4): 5.11
ACD/BCF (pH 7.4): 4518.69
ACD/KOC (pH 7.4): 14380.18
Polar Surface Area: 147 Å2
Polarizability: 57.1±0.5 10-24cm3
Surface Tension: 69.0±5.0 dyne/cm
Molar Volume: 392.7±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement