ChemSpider 2D Image | 6-({6-[4-(Methylsulfanyl)phenyl]-2-pyridinyl}methyl)-2-(2-thienyl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine | C24H22N4S2

6-({6-[4-(Methylsulfanyl)phenyl]-2-pyridinyl}methyl)-2-(2-thienyl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine

  • Molecular FormulaC24H22N4S2
  • Average mass430.588 Da
  • Monoisotopic mass430.128601 Da
  • ChemSpider ID21456804

More details:

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

6-({6-[4-(Methylsulfanyl)phenyl]-2-pyridinyl}methyl)-2-(2-thienyl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin [German] [ACD/IUPAC Name]
6-({6-[4-(Methylsulfanyl)phenyl]-2-pyridinyl}methyl)-2-(2-thienyl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine [ACD/IUPAC Name]
6-({6-[4-(Méthylsulfanyl)phényl]-2-pyridinyl}méthyl)-2-(2-thiényl)-5,6,7,8-tétrahydropyrido[4,3-d]pyrimidine [French] [ACD/IUPAC Name]
Pyrido[4,3-d]pyrimidine, 5,6,7,8-tetrahydro-6-[[6-[4-(methylthio)phenyl]-2-pyridinyl]methyl]-2-(2-thienyl)- [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: 545.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.4±3.0 kJ/mol
Flash Point: 283.7±30.1 °C
Index of Refraction: 1.716
Molar Refractivity: 125.4±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.10
ACD/LogD (pH 5.5): 4.40
ACD/BCF (pH 5.5): 1264.66
ACD/KOC (pH 5.5): 5574.62
ACD/LogD (pH 7.4): 4.46
ACD/BCF (pH 7.4): 1434.62
ACD/KOC (pH 7.4): 6323.82
Polar Surface Area: 95 Å2
Polarizability: 49.7±0.5 10-24cm3
Surface Tension: 75.1±5.0 dyne/cm
Molar Volume: 319.0±5.0 cm3

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