ChemSpider 2D Image | N-[2-({4-[2-(4-Benzyl-1-piperazinyl)-2-oxoethyl]-1,3-thiazol-2-yl}amino)-2-oxoethyl]-2,4-dichloro-N-isobutylbenzamide | C29H33Cl2N5O3S

N-[2-({4-[2-(4-Benzyl-1-piperazinyl)-2-oxoethyl]-1,3-thiazol-2-yl}amino)-2-oxoethyl]-2,4-dichloro-N-isobutylbenzamide

  • Molecular FormulaC29H33Cl2N5O3S
  • Average mass602.575 Da
  • Monoisotopic mass601.168091 Da
  • ChemSpider ID4234264

More details:

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

Benzamide, 2,4-dichloro-N-(2-methylpropyl)-N-[2-oxo-2-[[4-[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-2-thiazolyl]amino]ethyl]- [ACD/Index Name]
N-[2-({4-[2-(4-Benzyl-1-piperazinyl)-2-oxoethyl]-1,3-thiazol-2-yl}amino)-2-oxoethyl]-2,4-dichlor-N-isobutylbenzamid [German] [ACD/IUPAC Name]
N-[2-({4-[2-(4-Benzyl-1-piperazinyl)-2-oxoethyl]-1,3-thiazol-2-yl}amino)-2-oxoethyl]-2,4-dichloro-N-isobutylbenzamide [ACD/IUPAC Name]
N-[2-({4-[2-(4-Benzyl-1-pipérazinyl)-2-oxoéthyl]-1,3-thiazol-2-yl}amino)-2-oxoéthyl]-2,4-dichloro-N-isobutylbenzamide [French] [ACD/IUPAC Name]

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: 1.637
Molar Refractivity: 160.8±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.06
ACD/LogD (pH 5.5): 4.16
ACD/BCF (pH 5.5): 709.41
ACD/KOC (pH 5.5): 3034.84
ACD/LogD (pH 7.4): 4.33
ACD/BCF (pH 7.4): 1034.86
ACD/KOC (pH 7.4): 4427.12
Polar Surface Area: 114 Å2
Polarizability: 63.7±0.5 10-24cm3
Surface Tension: 61.8±3.0 dyne/cm
Molar Volume: 448.1±3.0 cm3

Click to predict properties on the Chemicalize site


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