ChemSpider 2D Image | 2,5-Difluoro-N-{1-[7-(4-methylbenzyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl]ethyl}benzamide | C23H25F2N5O

2,5-Difluoro-N-{1-[7-(4-methylbenzyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl]ethyl}benzamide

  • Molecular FormulaC23H25F2N5O
  • Average mass425.474 Da
  • Monoisotopic mass425.202728 Da
  • ChemSpider ID23052763

More details:

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

2,5-Difluor-N-{1-[7-(4-methylbenzyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl]ethyl}benzamid [German] [ACD/IUPAC Name]
2,5-Difluoro-N-{1-[7-(4-methylbenzyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl]ethyl}benzamide [ACD/IUPAC Name]
2,5-Difluoro-N-{1-[7-(4-méthylbenzyl)-6,7,8,9-tétrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazépin-3-yl]éthyl}benzamide [French] [ACD/IUPAC Name]
Benzamide, 2,5-difluoro-N-[1-[6,7,8,9-tetrahydro-7-[(4-methylphenyl)methyl]-5H-1,2,4-triazolo[4,3-d][1,4]diazepin-3-yl]ethyl]- [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: 1.629
Molar Refractivity: 115.6±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.66
ACD/LogD (pH 5.5): 1.04
ACD/BCF (pH 5.5): 1.66
ACD/KOC (pH 5.5): 19.76
ACD/LogD (pH 7.4): 2.34
ACD/BCF (pH 7.4): 33.01
ACD/KOC (pH 7.4): 392.52
Polar Surface Area: 63 Å2
Polarizability: 45.8±0.5 10-24cm3
Surface Tension: 44.7±7.0 dyne/cm
Molar Volume: 325.6±7.0 cm3

Click to predict properties on the Chemicalize site


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