ChemSpider 2D Image | 2-Butyl-3-{[2'-(1H-tetrazol-5-yl)(2,3-~2~H_2_)-4-biphenylyl](~2~H_2_)methyl}-1,3-diazaspiro[4.4]non-1-en-4-one | C25H24D4N6O

2-Butyl-3-{[2'-(1H-tetrazol-5-yl)(2,3-2H2)-4-biphenylyl](2H2)methyl}-1,3-diazaspiro[4.4]non-1-en-4-one

  • Molecular FormulaC25H24D4N6O
  • Average mass432.554 Da
  • Monoisotopic mass432.257568 Da
  • ChemSpider ID58796481

  • Non-standard isotope - Non-standard isotope

More details:

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

1,3-Diazaspiro[4.4]non-1-en-4-one, 2-butyl-3-[[2'-(1H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl-2,3-d2]methyl-d2]- [ACD/Index Name]
2-Butyl-3-{[2'-(1H-tetrazol-5-yl)(2,3-2H2)-4-biphenylyl](2H2)methyl}-1,3-diazaspiro[4.4]non-1-en-4-on [German] [ACD/IUPAC Name]
2-Butyl-3-{[2'-(1H-tetrazol-5-yl)(2,3-2H2)-4-biphenylyl](2H2)methyl}-1,3-diazaspiro[4.4]non-1-en-4-one [ACD/IUPAC Name]
2-Butyl-3-{[2'-(1H-tétrazol-5-yl)(2,3-2H2)-4-biphénylyl](2H2)méthyl}-1,3-diazaspiro[4.4]non-1-én-4-one [French] [ACD/IUPAC Name]
1216883-23-6 [RN]
Irbesartan D4

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

Density: 1.3±0.1 g/cm3
Boiling Point: 648.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.6±3.0 kJ/mol
Flash Point: 346.0±34.3 °C
Index of Refraction: 1.690
Molar Refractivity: 125.4±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.50
ACD/LogD (pH 5.5): 1.99
ACD/BCF (pH 5.5): 9.75
ACD/KOC (pH 5.5): 79.72
ACD/LogD (pH 7.4): 1.24
ACD/BCF (pH 7.4): 1.74
ACD/KOC (pH 7.4): 14.25
Polar Surface Area: 87 Å2
Polarizability: 49.7±0.5 10-24cm3
Surface Tension: 54.4±7.0 dyne/cm
Molar Volume: 328.2±7.0 cm3

Click to predict properties on the Chemicalize site


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