ChemSpider 2D Image | 2-Butyl-6-[(2-pyridinyloxy)methyl]-3-{[2'-(2H-tetrazol-5-yl)-4-biphenylyl]methyl}-4(3H)-quinazolinone | C32H29N7O2

2-Butyl-6-[(2-pyridinyloxy)methyl]-3-{[2'-(2H-tetrazol-5-yl)-4-biphenylyl]methyl}-4(3H)-quinazolinone

  • Molecular FormulaC32H29N7O2
  • Average mass543.618 Da
  • Monoisotopic mass543.238281 Da
  • ChemSpider ID8047778

More details:

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

2-Butyl-6-[(2-pyridinyloxy)methyl]-3-{[2'-(2H-tetrazol-5-yl)-4-biphenylyl]methyl}-4(3H)-chinazolinon [German] [ACD/IUPAC Name]
2-Butyl-6-[(2-pyridinyloxy)methyl]-3-{[2'-(2H-tetrazol-5-yl)-4-biphenylyl]methyl}-4(3H)-quinazolinone [ACD/IUPAC Name]
2-Butyl-6-[(2-pyridinyloxy)méthyl]-3-{[2'-(2H-tétrazol-5-yl)-4-biphénylyl]méthyl}-4(3H)-quinazolinone [French] [ACD/IUPAC Name]
4(3H)-Quinazolinone, 2-butyl-6-[(2-pyridinyloxy)methyl]-3-[[2'-(2H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl]methyl]- [ACD/Index Name]
2-Butyl-6-(pyridin-2-yloxymethyl)-3-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-3H-quinazolin-4-one
2-butyl-6-[(pyridin-2-yloxy)methyl]-3-{[2'-(2H-tetrazol-5-yl)biphenyl-4-yl]methyl}quinazolin-4(3H)-one

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

Density: 1.3±0.1 g/cm3
Boiling Point: 788.5±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 114.7±3.0 kJ/mol
Flash Point: 430.7±35.7 °C
Index of Refraction: 1.687
Molar Refractivity: 159.1±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 6.11
ACD/LogD (pH 5.5): 4.14
ACD/BCF (pH 5.5): 428.82
ACD/KOC (pH 5.5): 1219.51
ACD/LogD (pH 7.4): 3.37
ACD/BCF (pH 7.4): 72.07
ACD/KOC (pH 7.4): 204.96
Polar Surface Area: 109 Å2
Polarizability: 63.1±0.5 10-24cm3
Surface Tension: 53.8±7.0 dyne/cm
Molar Volume: 417.7±7.0 cm3

Click to predict properties on the Chemicalize site


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