ChemSpider 2D Image | 3-Cyclohexyl-N-{3-(2-oxo-2,3-dihydro-1,3-thiazol-4-yl)-5-[(2-thienylsulfonyl)amino]phenyl}propanamide | C22H25N3O4S3

3-Cyclohexyl-N-{3-(2-oxo-2,3-dihydro-1,3-thiazol-4-yl)-5-[(2-thienylsulfonyl)amino]phenyl}propanamide

  • Molecular FormulaC22H25N3O4S3
  • Average mass491.647 Da
  • Monoisotopic mass491.100708 Da
  • ChemSpider ID29408297

More details:






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

3-Cyclohexyl-N-{3-(2-oxo-2,3-dihydro-1,3-thiazol-4-yl)-5-[(2-thienylsulfonyl)amino]phenyl}propanamid [German] [ACD/IUPAC Name]
3-Cyclohexyl-N-{3-(2-oxo-2,3-dihydro-1,3-thiazol-4-yl)-5-[(2-thienylsulfonyl)amino]phenyl}propanamide [ACD/IUPAC Name]
3-Cyclohexyl-N-{3-(2-oxo-2,3-dihydro-1,3-thiazol-4-yl)-5-[(2-thiénylsulfonyl)amino]phényl}propanamide [French] [ACD/IUPAC Name]
3-Cyclohexyl-N-{3-(2-Oxo-2,3-Dihydro-1,3-Thiazol-4-Yl)-5-[(Thiophen-2-Ylsulfonyl)amino]phenyl}propanamide
Cyclohexanepropanamide, N-[3-(2,3-dihydro-2-oxo-4-thiazolyl)-5-[(2-thienylsulfonyl)amino]phenyl]- [ACD/Index Name]
10.1021/jm301793a

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.665
Molar Refractivity: 128.8±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.99
ACD/LogD (pH 5.5): 3.98
ACD/BCF (pH 5.5): 615.60
ACD/KOC (pH 5.5): 3424.98
ACD/LogD (pH 7.4): 3.47
ACD/BCF (pH 7.4): 190.40
ACD/KOC (pH 7.4): 1059.30
Polar Surface Area: 166 Å2
Polarizability: 51.0±0.5 10-24cm3
Surface Tension: 66.3±3.0 dyne/cm
Molar Volume: 346.9±3.0 cm3

Click to predict properties on the Chemicalize site






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