Found 1 result

Search term: VWUOWUZLQDJSCV-FQEVSTJZSA-N (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 1-[2-(4-Methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-yl]-N-[4-(methylsulfanyl)benzyl]-3-piperidinecarboxamide | C26H28N6OS

1-[2-(4-Methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-yl]-N-[4-(methylsulfanyl)benzyl]-3-piperidinecarboxamide

  • Molecular FormulaC26H28N6OS
  • Average mass472.605 Da
  • Monoisotopic mass472.204529 Da
  • ChemSpider ID28372523

More details:

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

1-[2-(4-Methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-yl]-N-[4-(methylsulfanyl)benzyl]-3-piperidincarboxamid [German] [ACD/IUPAC Name]
1-[2-(4-Methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-yl]-N-[4-(methylsulfanyl)benzyl]-3-piperidinecarboxamide [ACD/IUPAC Name]
1-[2-(4-Méthylphényl)-2H-pyrazolo[3,4-d]pyrimidin-4-yl]-N-[4-(méthylsulfanyl)benzyl]-3-pipéridinecarboxamide [French] [ACD/IUPAC Name]
3-Piperidinecarboxamide, 1-[2-(4-methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-yl]-N-[[4-(methylthio)phenyl]methyl]- [ACD/Index Name]
1-[2-(4-methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-yl]-N-[4-(methylthio)benzyl]piperidine-3-carboxamide

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: 1.696
Molar Refractivity: 138.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.77
ACD/LogD (pH 5.5): 4.55
ACD/BCF (pH 5.5): 1651.00
ACD/KOC (pH 5.5): 6763.68
ACD/LogD (pH 7.4): 4.60
ACD/BCF (pH 7.4): 1856.55
ACD/KOC (pH 7.4): 7605.72
Polar Surface Area: 101 Å2
Polarizability: 54.7±0.5 10-24cm3
Surface Tension: 53.9±7.0 dyne/cm
Molar Volume: 358.6±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement