ChemSpider 2D Image | 3-Ethyl-5-{5-[(4-ethyl-1-piperazinyl)sulfonyl]-2-propoxyphenyl}-2-(2-pyridinylmethyl)-2,4-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one | C28H35N7O4S

3-Ethyl-5-{5-[(4-ethyl-1-piperazinyl)sulfonyl]-2-propoxyphenyl}-2-(2-pyridinylmethyl)-2,4-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one

  • Molecular FormulaC28H35N7O4S
  • Average mass565.687 Da
  • Monoisotopic mass565.247131 Da
  • ChemSpider ID8135228

More details:

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

215297-27-1 [RN]
3-ETHYL-5-(5-((4-ETHYLPIPERAZIN-1-YL)SULFONYL)-2-PROPOXYPHENYL)-2-(PYRIDIN-2-YLMETHYL)-2,6-DIHYDRO-7H-PYRAZOLO(4,3-D)PYRIMIDIN-7-ONE
3-Ethyl-5-{5-[(4-ethyl-1-piperazinyl)sulfonyl]-2-propoxyphenyl}-2-(2-pyridinylmethyl)-2,4-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-on [German] [ACD/IUPAC Name]
3-Ethyl-5-{5-[(4-ethyl-1-piperazinyl)sulfonyl]-2-propoxyphenyl}-2-(2-pyridinylmethyl)-2,4-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one [ACD/IUPAC Name]
3-Éthyl-5-{5-[(4-éthyl-1-pipérazinyl)sulfonyl]-2-propoxyphényl}-2-(2-pyridinylméthyl)-2,4-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one [French] [ACD/IUPAC Name]
7H-Pyrazolo[4,3-d]pyrimidin-7-one, 3-ethyl-5-[5-[(4-ethyl-1-piperazinyl)sulfonyl]-2-propoxyphenyl]-2,4-dihydro-2-(2-pyridinylmethyl)- [ACD/Index Name]
3-ethyl-5-{5-[(4-ethylpiperazin-1-yl)sulfonyl]-2-propoxyphenyl}-2-(pyridin-2-ylmethyl)-2,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
UK-343664

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

3ES85MM31Y [DBID]
UNII:3ES85MM31Y [DBID]
UNII-3ES85MM31Y [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 764.0±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.3±3.0 kJ/mol
Flash Point: 415.9±35.7 °C
Index of Refraction: 1.671
Molar Refractivity: 154.4±0.5 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 2.92
ACD/LogD (pH 5.5): 1.00
ACD/BCF (pH 5.5): 1.34
ACD/KOC (pH 5.5): 14.46
ACD/LogD (pH 7.4): 2.47
ACD/BCF (pH 7.4): 39.79
ACD/KOC (pH 7.4): 428.92
Polar Surface Area: 130 Å2
Polarizability: 61.2±0.5 10-24cm3
Surface Tension: 55.5±7.0 dyne/cm
Molar Volume: 412.6±7.0 cm3

Click to predict properties on the Chemicalize site


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