ChemSpider 2D Image | 7-[5,6-Dimethyl-2-(1,3-thiazol-4-yl)-1H-benzimidazol-1-yl]-2,4-quinazolinediamine | C20H17N7S

7-[5,6-Dimethyl-2-(1,3-thiazol-4-yl)-1H-benzimidazol-1-yl]-2,4-quinazolinediamine

  • Molecular FormulaC20H17N7S
  • Average mass387.461 Da
  • Monoisotopic mass387.126617 Da
  • ChemSpider ID31133399

More details:

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

2,4-Quinazolinediamine, 7-[5,6-dimethyl-2-(4-thiazolyl)-1H-benzimidazol-1-yl]- [ACD/Index Name]
7-[5,6-Dimethyl-2-(1,3-thiazol-4-yl)-1H-benzimidazol-1-yl]-2,4-chinazolindiamin [German] [ACD/IUPAC Name]
7-[5,6-Dimethyl-2-(1,3-thiazol-4-yl)-1H-benzimidazol-1-yl]-2,4-quinazolinediamine [ACD/IUPAC Name]
7-[5,6-Diméthyl-2-(1,3-thiazol-4-yl)-1H-benzimidazol-1-yl]-2,4-quinazolinediamine [French] [ACD/IUPAC Name]
7-[5,6-Dimethyl-2-(1,3-Thiazol-4-Yl)-1h-Benzimidazol-1-Yl]quinazoline-2,4-Diamine
1VO

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

Density: 1.6±0.1 g/cm3
Boiling Point: 765.6±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.5±3.0 kJ/mol
Flash Point: 416.8±35.7 °C
Index of Refraction: 1.836
Molar Refractivity: 109.4±0.5 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.90
ACD/LogD (pH 5.5): 1.52
ACD/BCF (pH 5.5): 2.39
ACD/KOC (pH 5.5): 14.61
ACD/LogD (pH 7.4): 2.96
ACD/BCF (pH 7.4): 66.25
ACD/KOC (pH 7.4): 404.67
Polar Surface Area: 137 Å2
Polarizability: 43.4±0.5 10-24cm3
Surface Tension: 69.1±7.0 dyne/cm
Molar Volume: 247.8±7.0 cm3

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