ChemSpider 2D Image | 2-(4-Methylbenzyl)-8-[3-methyl-4-(3-methylphenyl)-1-piperazinyl]-6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidine | C28H32N6

2-(4-Methylbenzyl)-8-[3-methyl-4-(3-methylphenyl)-1-piperazinyl]-6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidine

  • Molecular FormulaC28H32N6
  • Average mass452.594 Da
  • Monoisotopic mass452.268860 Da
  • ChemSpider ID28373609

More details:

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

2-(4-Methylbenzyl)-8-[3-methyl-4-(3-methylphenyl)-1-piperazinyl]-6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidin [German] [ACD/IUPAC Name]
2-(4-Methylbenzyl)-8-[3-methyl-4-(3-methylphenyl)-1-piperazinyl]-6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidine [ACD/IUPAC Name]
2-(4-Méthylbenzyl)-8-[3-méthyl-4-(3-méthylphényl)-1-pipérazinyl]-6,7-dihydro-5H-cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidine [French] [ACD/IUPAC Name]
5H-Cyclopenta[d][1,2,4]triazolo[1,5-a]pyrimidine, 6,7-dihydro-8-[3-methyl-4-(3-methylphenyl)-1-piperazinyl]-2-[(4-methylphenyl)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: 1.695
Molar Refractivity: 136.8±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.01
ACD/LogD (pH 5.5): 4.63
ACD/BCF (pH 5.5): 1786.70
ACD/KOC (pH 5.5): 6704.19
ACD/LogD (pH 7.4): 4.78
ACD/BCF (pH 7.4): 2519.89
ACD/KOC (pH 7.4): 9455.31
Polar Surface Area: 50 Å2
Polarizability: 54.2±0.5 10-24cm3
Surface Tension: 50.0±7.0 dyne/cm
Molar Volume: 355.7±7.0 cm3

Click to predict properties on the Chemicalize site


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