ChemSpider 2D Image | N-(4,5-Diphenyl-1,3-thiazol-2-yl)-L-alaninamide | C18H17N3OS

N-(4,5-Diphenyl-1,3-thiazol-2-yl)-L-alaninamide

  • Molecular FormulaC18H17N3OS
  • Average mass323.412 Da
  • Monoisotopic mass323.109222 Da
  • ChemSpider ID23246952

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

N-(4,5-Diphenyl-1,3-thiazol-2-yl)-L-alaninamid [German] [ACD/IUPAC Name]
N-(4,5-Diphenyl-1,3-thiazol-2-yl)-L-alaninamide [ACD/IUPAC Name]
N-(4,5-Diphényl-1,3-thiazol-2-yl)-L-alaninamide [French] [ACD/IUPAC Name]
Propanamide, 2-amino-N-(4,5-diphenyl-2-thiazolyl)-, (2S)- [ACD/Index Name]
(S)-2-Amino-N-(4,5-diphenyl-thiazol-2-yl)-propionamide
SMAC mimetic compound 20f

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: 1.657
Molar Refractivity: 94.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.42
ACD/LogD (pH 5.5): 0.95
ACD/BCF (pH 5.5): 1.08
ACD/KOC (pH 5.5): 10.52
ACD/LogD (pH 7.4): 1.97
ACD/BCF (pH 7.4): 11.17
ACD/KOC (pH 7.4): 108.77
Polar Surface Area: 96 Å2
Polarizability: 37.4±0.5 10-24cm3
Surface Tension: 56.0±3.0 dyne/cm
Molar Volume: 256.3±3.0 cm3

Click to predict properties on the Chemicalize site


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