ChemSpider 2D Image | REPAGLINIDE ETHYL ESTER | C29H40N2O4

REPAGLINIDE ETHYL ESTER

  • Molecular FormulaC29H40N2O4
  • Average mass480.639 Da
  • Monoisotopic mass480.298798 Da
  • ChemSpider ID13639394

More details:

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

2-Éthoxy-4-[2-({3-méthyl-1-[2-(1-pipéridinyl)phényl]butyl}amino)-2-oxoéthyl]benzoate d'éthyle [French] [ACD/IUPAC Name]
Benzoic acid, 2-ethoxy-4-[2-[[3-methyl-1-[2-(1-piperidinyl)phenyl]butyl]amino]-2-oxoethyl]-, ethyl ester [ACD/Index Name]
Ethyl 2-ethoxy-4-[2-({3-methyl-1-[2-(1-piperidinyl)phenyl]butyl}amino)-2-oxoethyl]benzoate [ACD/IUPAC Name]
Ethyl-2-ethoxy-4-[2-({3-methyl-1-[2-(1-piperidinyl)phenyl]butyl}amino)-2-oxoethyl]benzoat [German] [ACD/IUPAC Name]
REPAGLINIDE ETHYL ESTER
(R)-Repaglinide Ethyl Ester
(S)-Ethyl 2-ethoxy-4-[[[N-[1-(2-piperidinophenyl)-3-methyl-1-butyl]amino]carbonyl]methyl]benzoate
(S)-Repaglinide Ethyl Ester
147770-06-7 [RN]
2-Ethoxy-4-[2-[[(1S)-3-methyl-1-[2-(1-piperidinyl)phenyl]butyl]amino]-2-oxoethyl]benzoic acid ethyl ester
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

3G7O9LRT91 [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 664.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.7±3.0 kJ/mol
Flash Point: 355.4±31.5 °C
Index of Refraction: 1.548
Molar Refractivity: 139.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 5.76
ACD/LogD (pH 5.5): 5.08
ACD/BCF (pH 5.5): 3449.30
ACD/KOC (pH 5.5): 9184.65
ACD/LogD (pH 7.4): 5.46
ACD/BCF (pH 7.4): 8313.91
ACD/KOC (pH 7.4): 22137.94
Polar Surface Area: 68 Å2
Polarizability: 55.3±0.5 10-24cm3
Surface Tension: 42.9±3.0 dyne/cm
Molar Volume: 439.7±3.0 cm3

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