ChemSpider 2D Image | 2-{[4-(3-Nitrophenyl)-1,3-thiazol-2-yl]amino}-2-oxoethyl 3-(4-morpholinylsulfonyl)benzoate | C22H20N4O8S2

2-{[4-(3-Nitrophenyl)-1,3-thiazol-2-yl]amino}-2-oxoethyl 3-(4-morpholinylsulfonyl)benzoate

  • Molecular FormulaC22H20N4O8S2
  • Average mass532.546 Da
  • Monoisotopic mass532.072266 Da
  • ChemSpider ID1747269

More details:

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

2-{[4-(3-Nitrophenyl)-1,3-thiazol-2-yl]amino}-2-oxoethyl 3-(4-morpholinylsulfonyl)benzoate [ACD/IUPAC Name]
2-{[4-(3-Nitrophenyl)-1,3-thiazol-2-yl]amino}-2-oxoethyl-3-(4-morpholinylsulfonyl)benzoat [German] [ACD/IUPAC Name]
3-(4-Morpholinylsulfonyl)benzoate de 2-{[4-(3-nitrophényl)-1,3-thiazol-2-yl]amino}-2-oxoéthyle [French] [ACD/IUPAC Name]
Benzoic acid, 3-(4-morpholinylsulfonyl)-, 2-[[4-(3-nitrophenyl)-2-thiazolyl]amino]-2-oxoethyl ester [ACD/Index Name]

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

ZINC03220141 [DBID]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.654
Molar Refractivity: 128.6±0.4 cm3
#H bond acceptors: 12
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 3.41
ACD/LogD (pH 5.5): 3.18
ACD/BCF (pH 5.5): 151.27
ACD/KOC (pH 5.5): 1245.89
ACD/LogD (pH 7.4): 2.50
ACD/BCF (pH 7.4): 31.53
ACD/KOC (pH 7.4): 259.65
Polar Surface Area: 197 Å2
Polarizability: 51.0±0.5 10-24cm3
Surface Tension: 71.7±3.0 dyne/cm
Molar Volume: 351.0±3.0 cm3

Click to predict properties on the Chemicalize site


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