ChemSpider 2D Image | Elisartan | C27H29ClN6O5

Elisartan

  • Molecular FormulaC27H29ClN6O5
  • Average mass553.009 Da
  • Monoisotopic mass552.188782 Da
  • ChemSpider ID159796

More details:

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

(±)-1-((Ethoxycarbonyl)oxy)ethyl 2-Butyl-4-chloro-1-((2'-(1H-tetrazol-5-yl)-1,1'-biphenyl-4-yl)methyl)-1H-imidazole-5-carboxylate
1-[(Ethoxycarbonyl)oxy]ethyl 2-butyl-4-chloro-1-{[2'-(2H-tetrazol-5-yl)-4-biphenylyl]methyl}-1H-imidazole-5-carboxylate [ACD/IUPAC Name]
1-[(ethoxycarbonyl)oxy]ethyl 2-butyl-4-chloro-1-{[2'-(2H-tetrazol-5-yl)biphenyl-4-yl]methyl}-1H-imidazole-5-carboxylate
1-[(Ethoxycarbonyl)oxy]ethyl-2-butyl-4-chlor-1-{[2'-(2H-tetrazol-5-yl)-4-biphenylyl]methyl}-1H-imidazol-5-carboxylat [German] [ACD/IUPAC Name]
149968-26-3 [RN]
1H-Imidazole-5-carboxylic acid, 2-butyl-4-chloro-1-[[2'-(2H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl]methyl]-, 1-[(ethoxycarbonyl)oxy]ethyl ester [ACD/Index Name]
2-Butyl-4-chloro-1-[[2'-(1H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl]methyl]-1H-imidazole-5-carboxylic Acid (±)-1-[(Ethoxycarbonyl)oxy]ethyl Ester
2-Butyl-4-chloro-1-{[2'-(2H-tétrazol-5-yl)-4-biphénylyl]méthyl}-1H-imidazole-5-carboxylate de 1-[(éthoxycarbonyl)oxy]éthyle [French] [ACD/IUPAC Name]
Elisartan [INN]
Elisartan, (R)-
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

7309 [DBID]
0S1JVU714D [DBID]
HN 65021 [DBID]
HN-65021 [DBID]
R4A1106L86 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 745.0±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.6±3.0 kJ/mol
Flash Point: 404.3±35.7 °C
Index of Refraction: 1.635
Molar Refractivity: 145.9±0.5 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 3
ACD/LogP: 6.19
ACD/LogD (pH 5.5): 3.76
ACD/BCF (pH 5.5): 216.23
ACD/KOC (pH 5.5): 741.89
ACD/LogD (pH 7.4): 2.99
ACD/BCF (pH 7.4): 37.12
ACD/KOC (pH 7.4): 127.35
Polar Surface Area: 134 Å2
Polarizability: 57.9±0.5 10-24cm3
Surface Tension: 50.4±7.0 dyne/cm
Molar Volume: 407.5±7.0 cm3

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