ChemSpider 2D Image | 4-[(5-{2-[(3-Fluorobenzyl)carbamoyl]-4-pyridinyl}-2H-tetrazol-2-yl)methyl]benzoic acid | C22H17FN6O3

4-[(5-{2-[(3-Fluorobenzyl)carbamoyl]-4-pyridinyl}-2H-tetrazol-2-yl)methyl]benzoic acid

  • Molecular FormulaC22H17FN6O3
  • Average mass432.407 Da
  • Monoisotopic mass432.134613 Da
  • ChemSpider ID24644322

More details:

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

4-[(5-{2-[(3-Fluorbenzyl)carbamoyl]-4-pyridinyl}-2H-tetrazol-2-yl)methyl]benzoesäure [German] [ACD/IUPAC Name]
4-[(5-{2-[(3-Fluorobenzyl)carbamoyl]-4-pyridinyl}-2H-tetrazol-2-yl)methyl]benzoic acid [ACD/IUPAC Name]
4-[(5-{2-[(3-Fluorobenzyl)carbamoyl]pyridin-4-Yl}-2h-Tetrazol-2-Yl)methyl]benzoic Acid
Acide 4-[(5-{2-[(3-fluorobenzyl)carbamoyl]-4-pyridinyl}-2H-tétrazol-2-yl)méthyl]benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-[[5-[2-[[[(3-fluorophenyl)methyl]amino]carbonyl]-4-pyridinyl]-2H-tetrazol-2-yl]methyl]- [ACD/Index Name]
3EJ
4-((5-(2-(3-fluorobenzylcarbamoyl)pyridin-4-yl)-2H-tetrazol-2-yl)methyl)benzoic acid

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.691
Molar Refractivity: 115.4±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.06
ACD/LogD (pH 5.5): 1.13
ACD/BCF (pH 5.5): 1.96
ACD/KOC (pH 5.5): 22.21
ACD/LogD (pH 7.4): -0.37
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 123 Å2
Polarizability: 45.7±0.5 10-24cm3
Surface Tension: 58.8±7.0 dyne/cm
Molar Volume: 301.5±7.0 cm3

Click to predict properties on the Chemicalize site


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