ChemSpider 2D Image | (4-Amino-1,2,5-oxadiazol-3-yl)[3-(1H-benzimidazol-2-ylmethoxy)phenyl]methanone | C17H13N5O3

(4-Amino-1,2,5-oxadiazol-3-yl)[3-(1H-benzimidazol-2-ylmethoxy)phenyl]methanone

  • Molecular FormulaC17H13N5O3
  • Average mass335.317 Da
  • Monoisotopic mass335.101837 Da
  • ChemSpider ID35033747

More details:

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

(4-Amino-1,2,5-oxadiazol-3-yl)[3-(1H-benzimidazol-2-ylmethoxy)phenyl]methanon [German] [ACD/IUPAC Name]
(4-Amino-1,2,5-oxadiazol-3-yl)[3-(1H-benzimidazol-2-ylmethoxy)phenyl]methanone [ACD/IUPAC Name]
(4-Amino-1,2,5-oxadiazol-3-yl)[3-(1H-benzimidazol-2-ylméthoxy)phényl]méthanone [French] [ACD/IUPAC Name]
(4-Azanyl-1,2,5-Oxadiazol-3-Yl)-[3-(1h-Benzimidazol-2-Ylmethoxy)phenyl]methanone
Methanone, (4-amino-1,2,5-oxadiazol-3-yl)[3-(1H-benzimidazol-2-ylmethoxy)phenyl]- [ACD/Index Name]
1VE

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

Density: 1.5±0.1 g/cm3
Boiling Point: 702.6±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.8±3.0 kJ/mol
Flash Point: 378.7±35.7 °C
Index of Refraction: 1.717
Molar Refractivity: 90.3±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.84
ACD/LogD (pH 5.5): 2.67
ACD/BCF (pH 5.5): 58.45
ACD/KOC (pH 5.5): 586.90
ACD/LogD (pH 7.4): 2.80
ACD/BCF (pH 7.4): 78.97
ACD/KOC (pH 7.4): 792.95
Polar Surface Area: 120 Å2
Polarizability: 35.8±0.5 10-24cm3
Surface Tension: 77.8±3.0 dyne/cm
Molar Volume: 229.4±3.0 cm3

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