ChemSpider 2D Image | 1-(2-Hydroxyethyl)-3-(2-methyl-2-butanyl)-5-[4-(2-methyl-1H-imidazol-1-yl)phenyl]-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-8(1H)-one | C23H28N6O2

1-(2-Hydroxyethyl)-3-(2-methyl-2-butanyl)-5-[4-(2-methyl-1H-imidazol-1-yl)phenyl]-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-8(1H)-one

  • Molecular FormulaC23H28N6O2
  • Average mass420.507 Da
  • Monoisotopic mass420.227386 Da
  • ChemSpider ID30831067

More details:

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

1-(2-Hydroxyethyl)-3-(2-methyl-2-butanyl)-5-[4-(2-methyl-1H-imidazol-1-yl)phenyl]-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-8(1H)-on [German] [ACD/IUPAC Name]
1-(2-Hydroxyethyl)-3-(2-methyl-2-butanyl)-5-[4-(2-methyl-1H-imidazol-1-yl)phenyl]-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-8(1H)-one [ACD/IUPAC Name]
1-(2-Hydroxyéthyl)-3-(2-méthyl-2-butanyl)-5-[4-(2-méthyl-1H-imidazol-1-yl)phényl]-6,7-dihydropyrazolo[4,3-e][1,4]diazépin-8(1H)-one [French] [ACD/IUPAC Name]
1-(2-Hydroxyethyl)-3-(2-Methylbutan-2-Yl)-5-[4-(2-Methyl-1h-Imidazol-1-Yl)phenyl]-6,7-Dihydropyrazolo[4,3-E][1,4]diazepin-8(1h)-One
Pyrazolo[4,3-e][1,4]diazepin-8(1H)-one, 3-(1,1-dimethylpropyl)-6,7-dihydro-1-(2-hydroxyethyl)-5-[4-(2-methyl-1H-imidazol-1-yl)phenyl]- [ACD/Index Name]
1L6

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: 1.659
Molar Refractivity: 120.0±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.37
ACD/LogD (pH 5.5): 0.75
ACD/BCF (pH 5.5): 1.30
ACD/KOC (pH 5.5): 22.66
ACD/LogD (pH 7.4): 1.65
ACD/BCF (pH 7.4): 10.28
ACD/KOC (pH 7.4): 179.64
Polar Surface Area: 97 Å2
Polarizability: 47.6±0.5 10-24cm3
Surface Tension: 50.3±7.0 dyne/cm
Molar Volume: 325.4±7.0 cm3

Click to predict properties on the Chemicalize site


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