ChemSpider 2D Image | N-{1-(4-Chlorophenyl)-2-[(2-methyl-2-propanyl)amino]-2-oxoethyl}-N-(4-ethoxyphenyl)-2-[5-(2-thienyl)-2H-tetrazol-2-yl]acetamide | C27H29ClN6O3S

N-{1-(4-Chlorophenyl)-2-[(2-methyl-2-propanyl)amino]-2-oxoethyl}-N-(4-ethoxyphenyl)-2-[5-(2-thienyl)-2H-tetrazol-2-yl]acetamide

  • Molecular FormulaC27H29ClN6O3S
  • Average mass553.076 Da
  • Monoisotopic mass552.171021 Da
  • ChemSpider ID2441226

More details:

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

2H-Tetrazole-2-acetamide, N-[1-(4-chlorophenyl)-2-[(1,1-dimethylethyl)amino]-2-oxoethyl]-N-(4-ethoxyphenyl)-5-(2-thienyl)- [ACD/Index Name]
N-{1-(4-Chlorophenyl)-2-[(2-methyl-2-propanyl)amino]-2-oxoethyl}-N-(4-ethoxyphenyl)-2-[5-(2-thienyl)-2H-tetrazol-2-yl]acetamide [ACD/IUPAC Name]
N-{1-(4-Chlorophényl)-2-[(2-méthyl-2-propanyl)amino]-2-oxoéthyl}-N-(4-éthoxyphényl)-2-[5-(2-thiényl)-2H-tétrazol-2-yl]acétamide [French] [ACD/IUPAC Name]
N-{1-(4-Chlorphenyl)-2-[(2-methyl-2-propanyl)amino]-2-oxoethyl}-N-(4-ethoxyphenyl)-2-[5-(2-thienyl)-2H-tetrazol-2-yl]acetamid [German] [ACD/IUPAC Name]

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

ASN 04484695 [DBID]

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: 1.645
Molar Refractivity: 152.2±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 4.65
ACD/LogD (pH 5.5): 4.11
ACD/BCF (pH 5.5): 779.68
ACD/KOC (pH 5.5): 4089.14
ACD/LogD (pH 7.4): 4.11
ACD/BCF (pH 7.4): 779.69
ACD/KOC (pH 7.4): 4089.20
Polar Surface Area: 130 Å2
Polarizability: 60.3±0.5 10-24cm3
Surface Tension: 50.5±7.0 dyne/cm
Molar Volume: 419.7±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement