ChemSpider 2D Image | {1-[4-(3,5-Dimethyl-1H-pyrazol-1-yl)-2-pyrimidinyl]-4-piperidinyl}(4-phenyl-1-piperazinyl)methanone | C25H31N7O

{1-[4-(3,5-Dimethyl-1H-pyrazol-1-yl)-2-pyrimidinyl]-4-piperidinyl}(4-phenyl-1-piperazinyl)methanone

  • Molecular FormulaC25H31N7O
  • Average mass445.560 Da
  • Monoisotopic mass445.259003 Da
  • ChemSpider ID26320401

More details:

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

{1-[4-(3,5-Dimethyl-1H-pyrazol-1-yl)-2-pyrimidinyl]-4-piperidinyl}(4-phenyl-1-piperazinyl)methanon [German] [ACD/IUPAC Name]
{1-[4-(3,5-Dimethyl-1H-pyrazol-1-yl)-2-pyrimidinyl]-4-piperidinyl}(4-phenyl-1-piperazinyl)methanone [ACD/IUPAC Name]
{1-[4-(3,5-Diméthyl-1H-pyrazol-1-yl)-2-pyrimidinyl]-4-pipéridinyl}(4-phényl-1-pipérazinyl)méthanone [French] [ACD/IUPAC Name]
Methanone, [1-[4-(3,5-dimethyl-1H-pyrazol-1-yl)-2-pyrimidinyl]-4-piperidinyl](4-phenyl-1-piperazinyl)- [ACD/Index Name]
(1-(4-(3,5-dimethyl-1H-pyrazol-1-yl)pyrimidin-2-yl)piperidin-4-yl)(4-phenylpiperazin-1-yl)methanone
[1-[4-(3,5-dimethylpyrazol-1-yl)pyrimidin-2-yl]piperidin-4-yl]-(4-phenylpiperazin-1-yl)methanone
{1-[4-(3,5-dimethyl-1H-pyrazol-1-yl)-2-pyrimidinyl]-4-piperidyl}(4-phenylpiperazino)methanone
1251680-57-5 [RN]
4-(3,5-dimethyl-1H-pyrazol-1-yl)-2-[4-(4-phenylpiperazine-1-carbonyl)piperidin-1-yl]pyrimidine
MFCD22596968

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 685.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.5±3.0 kJ/mol
Flash Point: 368.1±34.3 °C
Index of Refraction: 1.681
Molar Refractivity: 130.5±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.59
ACD/LogD (pH 5.5): 3.78
ACD/BCF (pH 5.5): 436.89
ACD/KOC (pH 5.5): 2693.47
ACD/LogD (pH 7.4): 3.78
ACD/BCF (pH 7.4): 441.34
ACD/KOC (pH 7.4): 2720.93
Polar Surface Area: 70 Å2
Polarizability: 51.7±0.5 10-24cm3
Surface Tension: 53.3±7.0 dyne/cm
Molar Volume: 344.9±7.0 cm3

Click to predict properties on the Chemicalize site


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