ChemSpider 2D Image | 3-(4-Fluoro-3-methoxybenzyl)-N-[1-(2-furyl)ethyl]-9-methoxy-N-methyl-7-oxo-1,2,3,4,5,7-hexahydropyrido[1,2-d][1,4]diazepine-10-carboxamide | C26H30FN3O5

3-(4-Fluoro-3-methoxybenzyl)-N-[1-(2-furyl)ethyl]-9-methoxy-N-methyl-7-oxo-1,2,3,4,5,7-hexahydropyrido[1,2-d][1,4]diazepine-10-carboxamide

  • Molecular FormulaC26H30FN3O5
  • Average mass483.532 Da
  • Monoisotopic mass483.216949 Da
  • ChemSpider ID22132538

More details:

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

3-(4-Fluor-3-methoxybenzyl)-N-[1-(2-furyl)ethyl]-9-methoxy-N-methyl-7-oxo-1,2,3,4,5,7-hexahydropyrido[1,2-d][1,4]diazepin-10-carboxamid [German] [ACD/IUPAC Name]
3-(4-Fluoro-3-methoxybenzyl)-N-[1-(2-furyl)ethyl]-9-methoxy-N-methyl-7-oxo-1,2,3,4,5,7-hexahydropyrido[1,2-d][1,4]diazepine-10-carboxamide [ACD/IUPAC Name]
3-(4-Fluoro-3-méthoxybenzyl)-N-[1-(2-furyl)éthyl]-9-méthoxy-N-méthyl-7-oxo-1,2,3,4,5,7-hexahydropyrido[1,2-d][1,4]diazépine-10-carboxamide [French] [ACD/IUPAC Name]
Pyrido[1,2-d][1,4]diazepine-10-carboxamide, 3-[(4-fluoro-3-methoxyphenyl)methyl]-N-[1-(2-furanyl)ethyl]-1,2,3,4,5,7-hexahydro-9-methoxy-N-methyl-7-oxo- [ACD/Index Name]
ZINC14880192

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

Density: 1.3±0.1 g/cm3
Boiling Point: 641.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.7±3.0 kJ/mol
Flash Point: 342.0±31.5 °C
Index of Refraction: 1.609
Molar Refractivity: 128.5±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.77
ACD/LogD (pH 5.5): 0.32
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.03
ACD/LogD (pH 7.4): 1.97
ACD/BCF (pH 7.4): 14.72
ACD/KOC (pH 7.4): 181.39
Polar Surface Area: 75 Å2
Polarizability: 51.0±0.5 10-24cm3
Surface Tension: 55.4±5.0 dyne/cm
Molar Volume: 371.0±5.0 cm3

Click to predict properties on the Chemicalize site


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