ChemSpider 2D Image | N-(2,6-Diethylphenyl)-5-[2-({4-[4-(2-hydroxyethyl)-1-piperazinyl]-2-methoxyphenyl}amino)-4-pyrimidinyl]-1H-pyrazole-3-carboxamide | C31H38N8O3

N-(2,6-Diethylphenyl)-5-[2-({4-[4-(2-hydroxyethyl)-1-piperazinyl]-2-methoxyphenyl}amino)-4-pyrimidinyl]-1H-pyrazole-3-carboxamide

  • Molecular FormulaC31H38N8O3
  • Average mass570.685 Da
  • Monoisotopic mass570.306702 Da
  • ChemSpider ID76811840

More details:

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

1H-Pyrazole-3-carboxamide, N-(2,6-diethylphenyl)-5-[2-[[4-[4-(2-hydroxyethyl)-1-piperazinyl]-2-methoxyphenyl]amino]-4-pyrimidinyl]- [ACD/Index Name]
N-(2,6-Diethylphenyl)-5-[2-({4-[4-(2-hydroxyethyl)-1-piperazinyl]-2-methoxyphenyl}amino)-4-pyrimidinyl]-1H-pyrazol-3-carboxamid [German] [ACD/IUPAC Name]
N-(2,6-Diethylphenyl)-5-[2-({4-[4-(2-hydroxyethyl)-1-piperazinyl]-2-methoxyphenyl}amino)-4-pyrimidinyl]-1H-pyrazole-3-carboxamide [ACD/IUPAC Name]
N-(2,6-Diéthylphényl)-5-[2-({4-[4-(2-hydroxyéthyl)-1-pipérazinyl]-2-méthoxyphényl}amino)-4-pyrimidinyl]-1H-pyrazole-3-carboxamide [French] [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: 1.657
Molar Refractivity: 163.9±0.3 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 4.03
ACD/LogD (pH 5.5): 1.57
ACD/BCF (pH 5.5): 3.17
ACD/KOC (pH 5.5): 22.77
ACD/LogD (pH 7.4): 3.14
ACD/BCF (pH 7.4): 120.24
ACD/KOC (pH 7.4): 863.23
Polar Surface Area: 132 Å2
Polarizability: 65.0±0.5 10-24cm3
Surface Tension: 65.0±3.0 dyne/cm
Molar Volume: 445.7±3.0 cm3

Click to predict properties on the Chemicalize site


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