ChemSpider 2D Image | Isopropyl 4-methyl-2-[({4-[(2-nitrophenyl)sulfonyl]-1-piperazinyl}acetyl)amino]-1,3-thiazole-5-carboxylate | C20H25N5O7S2

Isopropyl 4-methyl-2-[({4-[(2-nitrophenyl)sulfonyl]-1-piperazinyl}acetyl)amino]-1,3-thiazole-5-carboxylate

  • Molecular FormulaC20H25N5O7S2
  • Average mass511.572 Da
  • Monoisotopic mass511.119537 Da
  • ChemSpider ID66481628

More details:

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

4-Méthyl-2-[(2-{4-[(2-nitrophényl)sulfonyl]-1-pipérazinyl}acétyl)amino]-1,3-thiazole-5-carboxylate d'isopropyle [French] [ACD/IUPAC Name]
5-Thiazolecarboxylic acid, 4-methyl-2-[[2-[4-[(2-nitrophenyl)sulfonyl]-1-piperazinyl]acetyl]amino]-, 1-methylethyl ester [ACD/Index Name]
Isopropyl 4-methyl-2-[({4-[(2-nitrophenyl)sulfonyl]-1-piperazinyl}acetyl)amino]-1,3-thiazole-5-carboxylate [ACD/IUPAC Name]
Isopropyl-4-methyl-2-[({4-[(2-nitrophenyl)sulfonyl]-1-piperazinyl}acetyl)amino]-1,3-thiazol-5-carboxylat [German] [ACD/IUPAC Name]

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: 1.616
Molar Refractivity: 124.5±0.4 cm3
#H bond acceptors: 12
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 3.94
ACD/LogD (pH 5.5): 2.70
ACD/BCF (pH 5.5): 66.62
ACD/KOC (pH 5.5): 701.06
ACD/LogD (pH 7.4): 2.67
ACD/BCF (pH 7.4): 61.13
ACD/KOC (pH 7.4): 643.26
Polar Surface Area: 191 Å2
Polarizability: 49.4±0.5 10-24cm3
Surface Tension: 64.9±3.0 dyne/cm
Molar Volume: 356.5±3.0 cm3

Click to predict properties on the Chemicalize site


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