ChemSpider 2D Image | 4-(Butyl{[2'-(1H-tetrazol-5-yl)-4-biphenylyl]methyl}amino)pyrido[3,2-d]pyrimidine-6-carboxylic acid | C26H24N8O2

4-(Butyl{[2'-(1H-tetrazol-5-yl)-4-biphenylyl]methyl}amino)pyrido[3,2-d]pyrimidine-6-carboxylic acid

  • Molecular FormulaC26H24N8O2
  • Average mass480.521 Da
  • Monoisotopic mass480.202209 Da
  • ChemSpider ID23144289

More details:

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

4-(Butyl{[2'-(1H-tetrazol-5-yl)-4-biphenylyl]methyl}amino)pyrido[3,2-d]pyrimidin-6-carbonsäure [German] [ACD/IUPAC Name]
4-(Butyl{[2'-(1H-tetrazol-5-yl)-4-biphenylyl]methyl}amino)pyrido[3,2-d]pyrimidine-6-carboxylic acid [ACD/IUPAC Name]
Acide 4-(butyl{[2'-(1H-tétrazol-5-yl)-4-biphénylyl]méthyl}amino)pyrido[3,2-d]pyrimidine-6-carboxylique [French] [ACD/IUPAC Name]
Pyrido[3,2-d]pyrimidine-6-carboxylic acid, 4-[butyl[[2'-(2H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl]methyl]amino]- [ACD/Index Name]
4-{Butyl-[2'-(2H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-amino}-pyrido[3,2-d]pyrimidine-6-carboxylic 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: 740.6±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 113.4±3.0 kJ/mol
Flash Point: 401.7±35.7 °C
Index of Refraction: 1.698
Molar Refractivity: 135.9±0.3 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.43
ACD/LogD (pH 5.5): 1.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.36
ACD/LogD (pH 7.4): 0.62
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 134 Å2
Polarizability: 53.9±0.5 10-24cm3
Surface Tension: 75.2±3.0 dyne/cm
Molar Volume: 352.5±3.0 cm3

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