ChemSpider 2D Image | 5-(Difluoromethyl)-7-(1,3-dimethyl-1H-pyrazol-4-yl)-1-(3-methoxypropyl)-2-thioxo-2,3-dihydropyrido[2,3-d]pyrimidin-4(1H)-one | C17H19F2N5O2S

5-(Difluoromethyl)-7-(1,3-dimethyl-1H-pyrazol-4-yl)-1-(3-methoxypropyl)-2-thioxo-2,3-dihydropyrido[2,3-d]pyrimidin-4(1H)-one

  • Molecular FormulaC17H19F2N5O2S
  • Average mass395.427 Da
  • Monoisotopic mass395.122742 Da
  • ChemSpider ID21761359

More details:

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

5-(Difluormethyl)-7-(1,3-dimethyl-1H-pyrazol-4-yl)-1-(3-methoxypropyl)-2-thioxo-2,3-dihydropyrido[2,3-d]pyrimidin-4(1H)-on [German] [ACD/IUPAC Name]
5-(Difluoromethyl)-7-(1,3-dimethyl-1H-pyrazol-4-yl)-1-(3-methoxypropyl)-2-thioxo-2,3-dihydropyrido[2,3-d]pyrimidin-4(1H)-one [ACD/IUPAC Name]
5-(Difluorométhyl)-7-(1,3-diméthyl-1H-pyrazol-4-yl)-1-(3-méthoxypropyl)-2-thioxo-2,3-dihydropyrido[2,3-d]pyrimidin-4(1H)-one [French] [ACD/IUPAC Name]
Pyrido[2,3-d]pyrimidin-4(1H)-one, 5-(difluoromethyl)-7-(1,3-dimethyl-1H-pyrazol-4-yl)-2,3-dihydro-1-(3-methoxypropyl)-2-thioxo- [ACD/Index Name]
5-(difluoromethyl)-7-(1,3-dimethyl-1H-pyrazol-4-yl)-1-(3-methoxypropyl)-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one
5-(difluoromethyl)-7-(1,3-dimethyl-1H-pyrazol-4-yl)-2-mercapto-1-(3-methoxypropyl)pyrido[2,3-d]pyrimidin-4(1H)-one
5-(difluoromethyl)-7-(1,3-dimethylpyrazol-4-yl)-1-(3-methoxypropyl)-2-sulfanylhydropyridino[2,3-d]pyrimidin-4-one
5-Difluoromethyl-7-(1,3-dimethyl-1H-pyrazol-4-yl)-2-mercapto-1-(3-methoxy-propyl)-1H-pyrido[2,3-d]pyrimidin-4-one

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

Density: 1.5±0.1 g/cm3
Boiling Point: 584.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.3±3.0 kJ/mol
Flash Point: 307.3±32.9 °C
Index of Refraction: 1.649
Molar Refractivity: 99.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.00
ACD/LogD (pH 5.5): -1.27
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.40
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 111 Å2
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 45.2±7.0 dyne/cm
Molar Volume: 272.0±7.0 cm3

Click to predict properties on the Chemicalize site


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