ChemSpider 2D Image | 3-Ethyl 5-methyl (4S)-4-(2,3-dichlorophenyl)-2-{[2-(2-imino-4-oxo-1-imidazolidinyl)ethoxy]methyl}-6-methyl-1,4-dihydro-3,5-pyridinedicarboxylate | C23H26Cl2N4O6

3-Ethyl 5-methyl (4S)-4-(2,3-dichlorophenyl)-2-{[2-(2-imino-4-oxo-1-imidazolidinyl)ethoxy]methyl}-6-methyl-1,4-dihydro-3,5-pyridinedicarboxylate

  • Molecular FormulaC23H26Cl2N4O6
  • Average mass525.382 Da
  • Monoisotopic mass524.122925 Da
  • ChemSpider ID62670462

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(4S)-2-{[2-(2-Amino-4-oxo-4,5-dihydro-1H-imidazol-1-yl)éthoxy]méthyl}-4-(2,3-dichlorophényl)-6-méthyl-1,4-dihydro-3,5-pyridinedicarboxylate de 3-éthyle et de 5-méthyle [French] [ACD/IUPAC Name]
(4S)-4-(2,3-Dichlorophényl)-2-{[2-(2-imino-4-oxo-1-imidazolidinyl)éthoxy]méthyl}-6-méthyl-1,4-dihydro-3,5-pyridinedicarboxylate de 3-éthyle et de 5-méthyle [French] [ACD/IUPAC Name]
3,5-Pyridinedicarboxylic acid, 2-[[2-(2-amino-4,5-dihydro-4-oxo-1H-imidazol-1-yl)ethoxy]methyl]-4-(2,3-dichlorophenyl)-1,4-dihydro-6-methyl-, 3-ethyl 5-methyl ester, (4S)- [ACD/Index Name]
3,5-Pyridinedicarboxylic acid, 4-(2,3-dichlorophenyl)-1,4-dihydro-2-[[2-(2-imino-4-oxo-1-imidazolidinyl)ethoxy]methyl]-6-methyl-, 3-ethyl 5-methyl ester, (4S)- [ACD/Index Name]
3-Ethyl 5-methyl (4S)-2-{[2-(2-amino-4-oxo-4,5-dihydro-1H-imidazol-1-yl)ethoxy]methyl}-4-(2,3-dichlorophenyl)-6-methyl-1,4-dihydro-3,5-pyridinedicarboxylate [ACD/IUPAC Name]
3-Ethyl 5-methyl (4S)-4-(2,3-dichlorophenyl)-2-{[2-(2-imino-4-oxo-1-imidazolidinyl)ethoxy]methyl}-6-methyl-1,4-dihydro-3,5-pyridinedicarboxylate [ACD/IUPAC Name]
3-Ethyl-5-methyl-(4S)-2-{[2-(2-amino-4-oxo-4,5-dihydro-1H-imidazol-1-yl)ethoxy]methyl}-4-(2,3-dichlorphenyl)-6-methyl-1,4-dihydro-3,5-pyridindicarboxylat [German] [ACD/IUPAC Name]
3-Ethyl-5-methyl-(4S)-4-(2,3-dichlorphenyl)-2-{[2-(2-imino-4-oxo-1-imidazolidinyl)ethoxy]methyl}-6-methyl-1,4-dihydro-3,5-pyridindicarboxylat [German] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.628
Molar Refractivity: 128.2±0.5 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 3.77
ACD/LogD (pH 5.5): 3.64
ACD/BCF (pH 5.5): 345.30
ACD/KOC (pH 5.5): 2269.27
ACD/LogD (pH 7.4): 3.65
ACD/BCF (pH 7.4): 352.42
ACD/KOC (pH 7.4): 2316.13
Polar Surface Area: 130 Å2
Polarizability: 50.8±0.5 10-24cm3
Surface Tension: 51.7±7.0 dyne/cm
Molar Volume: 361.2±7.0 cm3

Click to predict properties on the Chemicalize site


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