ChemSpider 2D Image | [6-Methyl-1-phenyl-3-(2-thienyl)-1,6-dihydropyrrolo[2,3-c]pyrazol-5-yl][4-(2-pyrimidinyl)-1-piperazinyl]methanone | C25H23N7OS

[6-Methyl-1-phenyl-3-(2-thienyl)-1,6-dihydropyrrolo[2,3-c]pyrazol-5-yl][4-(2-pyrimidinyl)-1-piperazinyl]methanone

  • Molecular FormulaC25H23N7OS
  • Average mass469.561 Da
  • Monoisotopic mass469.168488 Da
  • ChemSpider ID28381532

More details:

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

[6-Methyl-1-phenyl-3-(2-thienyl)-1,6-dihydropyrrolo[2,3-c]pyrazol-5-yl][4-(2-pyrimidinyl)-1-piperazinyl]methanon [German] [ACD/IUPAC Name]
[6-Methyl-1-phenyl-3-(2-thienyl)-1,6-dihydropyrrolo[2,3-c]pyrazol-5-yl][4-(2-pyrimidinyl)-1-piperazinyl]methanone [ACD/IUPAC Name]
[6-Méthyl-1-phényl-3-(2-thiényl)-1,6-dihydropyrrolo[2,3-c]pyrazol-5-yl][4-(2-pyrimidinyl)-1-pipérazinyl]méthanone [French] [ACD/IUPAC Name]
Methanone, [1,6-dihydro-6-methyl-1-phenyl-3-(2-thienyl)pyrrolo[2,3-c]pyrazol-5-yl][4-(2-pyrimidinyl)-1-piperazinyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 681.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.0±3.0 kJ/mol
Flash Point: 366.0±34.3 °C
Index of Refraction: 1.756
Molar Refractivity: 135.9±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.14
ACD/LogD (pH 5.5): 3.02
ACD/BCF (pH 5.5): 109.39
ACD/KOC (pH 5.5): 927.36
ACD/LogD (pH 7.4): 3.14
ACD/BCF (pH 7.4): 143.36
ACD/KOC (pH 7.4): 1215.33
Polar Surface Area: 100 Å2
Polarizability: 53.9±0.5 10-24cm3
Surface Tension: 62.9±7.0 dyne/cm
Molar Volume: 331.7±7.0 cm3

Click to predict properties on the Chemicalize site


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