ChemSpider 2D Image | 2,5-Dimethyl-N-{[7-(2,4,6-trimethoxybenzyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl]methyl}-3-furamide | C24H31N5O5

2,5-Dimethyl-N-{[7-(2,4,6-trimethoxybenzyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl]methyl}-3-furamide

  • Molecular FormulaC24H31N5O5
  • Average mass469.533 Da
  • Monoisotopic mass469.232513 Da
  • ChemSpider ID23048168

More details:

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

2,5-Dimethyl-N-{[7-(2,4,6-trimethoxybenzyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl]methyl}-3-furamid [German] [ACD/IUPAC Name]
2,5-Dimethyl-N-{[7-(2,4,6-trimethoxybenzyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl]methyl}-3-furamide [ACD/IUPAC Name]
2,5-Diméthyl-N-{[7-(2,4,6-triméthoxybenzyl)-6,7,8,9-tétrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazépin-3-yl]méthyl}-3-furamide [French] [ACD/IUPAC Name]
3-Furancarboxamide, 2,5-dimethyl-N-[[6,7,8,9-tetrahydro-7-[(2,4,6-trimethoxyphenyl)methyl]-5H-1,2,4-triazolo[4,3-d][1,4]diazepin-3-yl]methyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.616
Molar Refractivity: 125.5±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 1.53
ACD/LogD (pH 5.5): 1.30
ACD/BCF (pH 5.5): 3.74
ACD/KOC (pH 5.5): 53.97
ACD/LogD (pH 7.4): 2.05
ACD/BCF (pH 7.4): 20.93
ACD/KOC (pH 7.4): 301.64
Polar Surface Area: 104 Å2
Polarizability: 49.8±0.5 10-24cm3
Surface Tension: 45.8±7.0 dyne/cm
Molar Volume: 359.1±7.0 cm3

Click to predict properties on the Chemicalize site


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