ChemSpider 2D Image | 2-Methoxyethyl 4-({4-[(2,5-dichlorophenyl)sulfonyl]-3-methyl-1-piperazinyl}carbonyl)-6-methyl-2-phenyl-5-pyrimidinecarboxylate | C27H28Cl2N4O6S

2-Methoxyethyl 4-({4-[(2,5-dichlorophenyl)sulfonyl]-3-methyl-1-piperazinyl}carbonyl)-6-methyl-2-phenyl-5-pyrimidinecarboxylate

  • Molecular FormulaC27H28Cl2N4O6S
  • Average mass607.505 Da
  • Monoisotopic mass606.110657 Da
  • ChemSpider ID2880790

More details:

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

2-Methoxyethyl 4-({4-[(2,5-dichlorophenyl)sulfonyl]-3-methyl-1-piperazinyl}carbonyl)-6-methyl-2-phenyl-5-pyrimidinecarboxylate [ACD/IUPAC Name]
2-Methoxyethyl-4-({4-[(2,5-dichlorphenyl)sulfonyl]-3-methyl-1-piperazinyl}carbonyl)-6-methyl-2-phenyl-5-pyrimidincarboxylat [German] [ACD/IUPAC Name]
4-({4-[(2,5-Dichlorophényl)sulfonyl]-3-méthyl-1-pipérazinyl}carbonyl)-6-méthyl-2-phényl-5-pyrimidinecarboxylate de 2-méthoxyéthyle [French] [ACD/IUPAC Name]
5-Pyrimidinecarboxylic acid, 4-[[4-[(2,5-dichlorophenyl)sulfonyl]-3-methyl-1-piperazinyl]carbonyl]-6-methyl-2-phenyl-, 2-methoxyethyl ester [ACD/Index 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: 695.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.8±3.0 kJ/mol
Flash Point: 374.3±34.3 °C
Index of Refraction: 1.597
Molar Refractivity: 150.6±0.4 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 2.92
ACD/LogD (pH 5.5): 3.77
ACD/BCF (pH 5.5): 428.42
ACD/KOC (pH 5.5): 2663.77
ACD/LogD (pH 7.4): 3.77
ACD/BCF (pH 7.4): 428.42
ACD/KOC (pH 7.4): 2663.77
Polar Surface Area: 127 Å2
Polarizability: 59.7±0.5 10-24cm3
Surface Tension: 55.0±3.0 dyne/cm
Molar Volume: 442.0±3.0 cm3

Click to predict properties on the Chemicalize site


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