ChemSpider 2D Image | 6-(4-Methoxyphenyl)-2-methyl-6-[3-(5-pyrimidinyl)phenyl]-6H-pyrrolo[3,4-d][1,3]thiazol-4-amine | C23H19N5OS

6-(4-Methoxyphenyl)-2-methyl-6-[3-(5-pyrimidinyl)phenyl]-6H-pyrrolo[3,4-d][1,3]thiazol-4-amine

  • Molecular FormulaC23H19N5OS
  • Average mass413.495 Da
  • Monoisotopic mass413.131042 Da
  • ChemSpider ID30811787

More details:

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

6-(4-Methoxyphenyl)-2-methyl-6-[3-(5-pyrimidinyl)phenyl]-6H-pyrrolo[3,4-d][1,3]thiazol-4-amin [German] [ACD/IUPAC Name]
6-(4-Methoxyphenyl)-2-methyl-6-[3-(5-pyrimidinyl)phenyl]-6H-pyrrolo[3,4-d][1,3]thiazol-4-amine [ACD/IUPAC Name]
6-(4-Méthoxyphényl)-2-méthyl-6-[3-(5-pyrimidinyl)phényl]-6H-pyrrolo[3,4-d][1,3]thiazol-4-amine [French] [ACD/IUPAC Name]
6H-Pyrrolo[3,4-d]thiazol-4-amine, 6-(4-methoxyphenyl)-2-methyl-6-[3-(5-pyrimidinyl)phenyl]- [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: 630.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.3±3.0 kJ/mol
Flash Point: 335.3±34.3 °C
Index of Refraction: 1.726
Molar Refractivity: 119.3±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.22
ACD/LogD (pH 5.5): 2.79
ACD/BCF (pH 5.5): 78.19
ACD/KOC (pH 5.5): 787.91
ACD/LogD (pH 7.4): 2.80
ACD/BCF (pH 7.4): 78.33
ACD/KOC (pH 7.4): 789.40
Polar Surface Area: 115 Å2
Polarizability: 47.3±0.5 10-24cm3
Surface Tension: 56.5±7.0 dyne/cm
Molar Volume: 300.3±7.0 cm3

Click to predict properties on the Chemicalize site


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