ChemSpider 2D Image | 1-{7-Cyclohexyl-6-[4-(4-methyl-1-piperazinyl)benzyl]-7H-pyrrolo[2,3-d]pyrimidin-2-yl}methanamine | C25H34N6

1-{7-Cyclohexyl-6-[4-(4-methyl-1-piperazinyl)benzyl]-7H-pyrrolo[2,3-d]pyrimidin-2-yl}methanamine

  • Molecular FormulaC25H34N6
  • Average mass418.578 Da
  • Monoisotopic mass418.284485 Da
  • ChemSpider ID22376815

More details:

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

1-{7-Cyclohexyl-6-[4-(4-methyl-1-piperazinyl)benzyl]-7H-pyrrolo[2,3-d]pyrimidin-2-yl}methanamin [German] [ACD/IUPAC Name]
1-{7-Cyclohexyl-6-[4-(4-methyl-1-piperazinyl)benzyl]-7H-pyrrolo[2,3-d]pyrimidin-2-yl}methanamine [ACD/IUPAC Name]
1-{7-Cyclohexyl-6-[4-(4-méthyl-1-pipérazinyl)benzyl]-7H-pyrrolo[2,3-d]pyrimidin-2-yl}méthanamine [French] [ACD/IUPAC Name]
1-{7-cyclohexyl-6-[4-(4-methylpiperazin-1-yl)benzyl]-7H-pyrrolo[2,3-d]pyrimidin-2-yl}methanamine
7H-Pyrrolo[2,3-d]pyrimidine-2-methanamine, 7-cyclohexyl-6-[[4-(4-methyl-1-piperazinyl)phenyl]methyl]- [ACD/Index Name]
(7-cyclohexyl-6-{[4-(4-methylpiperazin-1-yl)phenyl]methyl}-7H-pyrrolo[2,3-d]pyrimidin-2-yl)methanamine
(7-cyclohexyl-6-{[4-(4-methylpiperazin-1-yl)phenyl]methyl}pyrrolo[2,3-d]pyrimidin-2-yl)methanamine

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: 1.680
Molar Refractivity: 124.7±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.23
ACD/LogD (pH 5.5): -0.83
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 2.14
ACD/BCF (pH 7.4): 17.66
ACD/KOC (pH 7.4): 179.39
Polar Surface Area: 63 Å2
Polarizability: 49.4±0.5 10-24cm3
Surface Tension: 52.3±7.0 dyne/cm
Molar Volume: 329.9±7.0 cm3

Click to predict properties on the Chemicalize site


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