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

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

  • Molecular FormulaC29H33Cl2N5O3S
  • Average mass602.575 Da
  • Monoisotopic mass601.168091 Da
  • ChemSpider ID3582857

More details:

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

4-Thiazoleacetamide, 2-[[2-[(2,4-dichlorobenzoyl)(1-methylethyl)amino]acetyl]amino]-N-[1-(phenylmethyl)-4-piperidinyl]- [ACD/Index Name]
N-{2-[(4-{2-[(1-Benzyl-4-piperidinyl)amino]-2-oxoethyl}-1,3-thiazol-2-yl)amino]-2-oxoethyl}-2,4-dichlor-N-isopropylbenzamid [German] [ACD/IUPAC Name]
N-{2-[(4-{2-[(1-Benzyl-4-piperidinyl)amino]-2-oxoethyl}-1,3-thiazol-2-yl)amino]-2-oxoethyl}-2,4-dichloro-N-isopropylbenzamide [ACD/IUPAC Name]
N-{2-[(4-{2-[(1-Benzyl-4-pipéridinyl)amino]-2-oxoéthyl}-1,3-thiazol-2-yl)amino]-2-oxoéthyl}-2,4-dichloro-N-isopropylbenzamide [French] [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: 1.644
Molar Refractivity: 159.9±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 4.22
ACD/LogD (pH 5.5): 2.13
ACD/BCF (pH 5.5): 7.00
ACD/KOC (pH 5.5): 31.64
ACD/LogD (pH 7.4): 3.64
ACD/BCF (pH 7.4): 227.56
ACD/KOC (pH 7.4): 1028.50
Polar Surface Area: 123 Å2
Polarizability: 63.4±0.5 10-24cm3
Surface Tension: 65.5±5.0 dyne/cm
Molar Volume: 441.6±5.0 cm3

Click to predict properties on the Chemicalize site


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