Found 411 results

Search term: MF = 'C_{29}H_{31}N_{7}O_{2}'
ChemSpider 2D Image | 3-{(1-Cyclopentyl-1H-tetrazol-5-yl)[(2-furylmethyl)(3-pyridinylmethyl)amino]methyl}-5,7-dimethyl-2(1H)-quinolinone | C29H31N7O2

3-{(1-Cyclopentyl-1H-tetrazol-5-yl)[(2-furylmethyl)(3-pyridinylmethyl)amino]methyl}-5,7-dimethyl-2(1H)-quinolinone

  • Molecular FormulaC29H31N7O2
  • Average mass509.602 Da
  • Monoisotopic mass509.253937 Da
  • ChemSpider ID2402360

More details:

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

2(1H)-Quinolinone, 3-[(1-cyclopentyl-1H-tetrazol-5-yl)[(2-furanylmethyl)(3-pyridinylmethyl)amino]methyl]-5,7-dimethyl- [ACD/Index Name]
3-{(1-Cyclopentyl-1H-tetrazol-5-yl)[(2-furylmethyl)(3-pyridinylmethyl)amino]methyl}-5,7-dimethyl-2(1H)-chinolinon [German] [ACD/IUPAC Name]
3-{(1-Cyclopentyl-1H-tétrazol-5-yl)[(2-furylméthyl)(3-pyridinylméthyl)amino]méthyl}-5,7-diméthyl-2(1H)-quinoléinone [French] [ACD/IUPAC Name]
3-{(1-Cyclopentyl-1H-tetrazol-5-yl)[(2-furylmethyl)(3-pyridinylmethyl)amino]methyl}-5,7-dimethyl-2(1H)-quinolinone [ACD/IUPAC Name]

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

BAS 04421009 [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: 736.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 107.5±3.0 kJ/mol
Flash Point: 399.3±32.9 °C
Index of Refraction: 1.707
Molar Refractivity: 146.0±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 5.58
ACD/LogD (pH 5.5): 3.77
ACD/BCF (pH 5.5): 422.31
ACD/KOC (pH 5.5): 2548.93
ACD/LogD (pH 7.4): 3.83
ACD/BCF (pH 7.4): 474.77
ACD/KOC (pH 7.4): 2865.59
Polar Surface Area: 102 Å2
Polarizability: 57.9±0.5 10-24cm3
Surface Tension: 55.3±7.0 dyne/cm
Molar Volume: 374.8±7.0 cm3

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