ChemSpider 2D Image | 4-Chlorobenzyl 4-(3-(5-methyl-2-oxo-2,3-dihydrobenzo[d]oxazol-6-yl)-3-oxopropyl)piperazine-1-carboxylate | C23H24ClN3O5

4-Chlorobenzyl 4-(3-(5-methyl-2-oxo-2,3-dihydrobenzo[d]oxazol-6-yl)-3-oxopropyl)piperazine-1-carboxylate

  • Molecular FormulaC23H24ClN3O5
  • Average mass457.907 Da
  • Monoisotopic mass457.140442 Da
  • ChemSpider ID30854951

More details:

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

1144035-43-7 [RN]
1-Piperazinecarboxylic acid, 4-[3-(2,3-dihydro-5-methyl-2-oxo-6-benzoxazolyl)-3-oxopropyl]-, (4-chlorophenyl)methyl ester [ACD/Index Name]
4-[3-(5-Méthyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)-3-oxopropyl]-1-pipérazinecarboxylate de 4-chlorobenzyle [French] [ACD/IUPAC Name]
4-Chlorbenzyl-4-[3-(5-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)-3-oxopropyl]-1-piperazincarboxylat [German] [ACD/IUPAC Name]
4-Chlorobenzyl 4-(3-(5-methyl-2-oxo-2,3-dihydrobenzo[d]oxazol-6-yl)-3-oxopropyl)piperazine-1-carboxylate
4-Chlorobenzyl 4-[3-(5-methyl-2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)-3-oxopropyl]-1-piperazinecarboxylate [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: 1.606
Molar Refractivity: 117.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.49
ACD/LogD (pH 5.5): 2.84
ACD/BCF (pH 5.5): 58.06
ACD/KOC (pH 5.5): 410.65
ACD/LogD (pH 7.4): 3.47
ACD/BCF (pH 7.4): 250.19
ACD/KOC (pH 7.4): 1769.48
Polar Surface Area: 88 Å2
Polarizability: 46.7±0.5 10-24cm3
Surface Tension: 54.7±3.0 dyne/cm
Molar Volume: 341.3±3.0 cm3

Click to predict properties on the Chemicalize site


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