ChemSpider 2D Image | N-{4-[(2-{[(4-Chloro-2-methylphenoxy)acetyl]carbamothioyl}hydrazino)carbonyl]phenyl}-4-(2-methyl-2-propanyl)benzamide | C28H29ClN4O4S

N-{4-[(2-{[(4-Chloro-2-methylphenoxy)acetyl]carbamothioyl}hydrazino)carbonyl]phenyl}-4-(2-methyl-2-propanyl)benzamide

  • Molecular FormulaC28H29ClN4O4S
  • Average mass553.072 Da
  • Monoisotopic mass552.159790 Da
  • ChemSpider ID3693829

More details:

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

Benzoic acid, 4-[[4-(1,1-dimethylethyl)benzoyl]amino]-, 2-[[[2-(4-chloro-2-methylphenoxy)acetyl]amino]thioxomethyl]hydrazide [ACD/Index Name]
N-{4-[(2-{[(4-Chlor-2-methylphenoxy)acetyl]carbamothioyl}hydrazino)carbonyl]phenyl}-4-(2-methyl-2-propanyl)benzamid [German] [ACD/IUPAC Name]
N-{4-[(2-{[(4-Chloro-2-methylphenoxy)acetyl]carbamothioyl}hydrazino)carbonyl]phenyl}-4-(2-methyl-2-propanyl)benzamide [ACD/IUPAC Name]
N-{4-[(2-{[2-(4-Chloro-2-méthylphénoxy)acétyl]carbamothioyl}hydrazino)carbonyl]phényl}-4-(2-méthyl-2-propanyl)benzamide [French] [ACD/IUPAC Name]
4-(4-TERT-BUTYLBENZAMIDO)-N-({[2-(4-CHLORO-2-METHYLPHENOXY)ACETAMIDO]METHANETHIOYL}AMINO)BENZAMIDE
4-tert-butyl-N-(4-{[2-({[(4-chloro-2-methylphenoxy)acetyl]amino}carbonothioyl)hydrazino]carbonyl}phenyl)benzamide

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: 1.638
Molar Refractivity: 152.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.79
ACD/LogD (pH 5.5): 4.27
ACD/BCF (pH 5.5): 1024.52
ACD/KOC (pH 5.5): 4951.02
ACD/LogD (pH 7.4): 3.93
ACD/BCF (pH 7.4): 477.34
ACD/KOC (pH 7.4): 2306.76
Polar Surface Area: 141 Å2
Polarizability: 60.5±0.5 10-24cm3
Surface Tension: 55.8±3.0 dyne/cm
Molar Volume: 424.7±3.0 cm3

Click to predict properties on the Chemicalize site


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