ChemSpider 2D Image | 7-({4-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]-5-methyl-1,2-oxazol-3-yl}carbonyl)-2-(4-methoxyphenyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-one | C27H26N6O5

7-({4-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]-5-methyl-1,2-oxazol-3-yl}carbonyl)-2-(4-methoxyphenyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-one

  • Molecular FormulaC27H26N6O5
  • Average mass514.532 Da
  • Monoisotopic mass514.196472 Da
  • ChemSpider ID34267633

More details:

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

7-({4-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]-5-methyl-1,2-oxazol-3-yl}carbonyl)-2-(4-methoxyphenyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-on [German] [ACD/IUPAC Name]
7-({4-[(3,5-Dimethyl-1,2-oxazol-4-yl)methyl]-5-methyl-1,2-oxazol-3-yl}carbonyl)-2-(4-methoxyphenyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-one [ACD/IUPAC Name]
7-({4-[(3,5-Diméthyl-1,2-oxazol-4-yl)méthyl]-5-méthyl-1,2-oxazol-3-yl}carbonyl)-2-(4-méthoxyphényl)-5,6,7,8-tétrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-one [French] [ACD/IUPAC Name]
Pyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-one, 7-[[4-[(3,5-dimethyl-4-isoxazolyl)methyl]-5-methyl-3-isoxazolyl]carbonyl]-5,6,7,8-tetrahydro-2-(4-methoxyphenyl)- [ACD/Index Name]
7-({4-[(3,5-dimethyl-4-isoxazolyl)methyl]-5-methyl-3-isoxazolyl}carbonyl)-2-(4-methoxyphenyl)-5,6,7,8-tetrahydropyrazolo[1,5-a]pyrido[4,3-d]pyrimidin-9(1H)-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: 785.0±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 114.2±3.0 kJ/mol
Flash Point: 428.5±35.7 °C
Index of Refraction: 1.721
Molar Refractivity: 136.9±0.5 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 1.92
ACD/LogD (pH 5.5): 0.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.78
ACD/LogD (pH 7.4): 1.68
ACD/BCF (pH 7.4): 8.89
ACD/KOC (pH 7.4): 126.59
Polar Surface Area: 126 Å2
Polarizability: 54.3±0.5 10-24cm3
Surface Tension: 57.5±7.0 dyne/cm
Molar Volume: 346.5±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement