ChemSpider 2D Image | 6-Chloro-7-[5,6-dimethyl-2-(1,3-thiazol-2-yl)-1H-benzimidazol-1-yl]-2,4-quinazolinediamine | C20H16ClN7S

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

  • Molecular FormulaC20H16ClN7S
  • Average mass421.906 Da
  • Monoisotopic mass421.087646 Da
  • ChemSpider ID31133391

More details:

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

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

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

Density: 1.6±0.1 g/cm3
Boiling Point: 779.3±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 113.4±3.0 kJ/mol
Flash Point: 425.1±35.7 °C
Index of Refraction: 1.841
Molar Refractivity: 114.0±0.5 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.50
ACD/LogD (pH 5.5): 2.00
ACD/BCF (pH 5.5): 5.50
ACD/KOC (pH 5.5): 26.29
ACD/LogD (pH 7.4): 3.43
ACD/BCF (pH 7.4): 147.19
ACD/KOC (pH 7.4): 703.85
Polar Surface Area: 137 Å2
Polarizability: 45.2±0.5 10-24cm3
Surface Tension: 69.9±7.0 dyne/cm
Molar Volume: 257.1±7.0 cm3

Click to predict properties on the Chemicalize site


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