ChemSpider 2D Image | N-[1-(7-{[5-(4-Chlorophenyl)-2-furyl]methyl}-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl)-3-methylbutyl]-2-methoxyacetamide | C25H32ClN5O3

N-[1-(7-{[5-(4-Chlorophenyl)-2-furyl]methyl}-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl)-3-methylbutyl]-2-methoxyacetamide

  • Molecular FormulaC25H32ClN5O3
  • Average mass486.006 Da
  • Monoisotopic mass485.219360 Da
  • ChemSpider ID22121909

More details:

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

Acetamide, N-[1-[7-[[5-(4-chlorophenyl)-2-furanyl]methyl]-6,7,8,9-tetrahydro-5H-1,2,4-triazolo[4,3-d][1,4]diazepin-3-yl]-3-methylbutyl]-2-methoxy- [ACD/Index Name]
N-[1-(7-{[5-(4-Chlorophenyl)-2-furyl]methyl}-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl)-3-methylbutyl]-2-methoxyacetamide [ACD/IUPAC Name]
N-[1-(7-{[5-(4-Chlorophényl)-2-furyl]méthyl}-6,7,8,9-tétrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazépin-3-yl)-3-méthylbutyl]-2-méthoxyacétamide [French] [ACD/IUPAC Name]
N-[1-(7-{[5-(4-Chlorphenyl)-2-furyl]methyl}-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-yl)-3-methylbutyl]-2-methoxyacetamid [German] [ACD/IUPAC 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: 1.627
Molar Refractivity: 132.3±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.37
ACD/LogD (pH 5.5): 2.37
ACD/BCF (pH 5.5): 23.01
ACD/KOC (pH 5.5): 186.79
ACD/LogD (pH 7.4): 3.20
ACD/BCF (pH 7.4): 155.32
ACD/KOC (pH 7.4): 1260.80
Polar Surface Area: 85 Å2
Polarizability: 52.5±0.5 10-24cm3
Surface Tension: 47.2±7.0 dyne/cm
Molar Volume: 373.2±7.0 cm3

Click to predict properties on the Chemicalize site


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