ChemSpider 2D Image | 1-(3-Chlorophenyl)-3-{4-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl]-1,3-thiazol-2-yl}urea | C18H15ClN6OS2

1-(3-Chlorophenyl)-3-{4-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl]-1,3-thiazol-2-yl}urea

  • Molecular FormulaC18H15ClN6OS2
  • Average mass430.934 Da
  • Monoisotopic mass430.043732 Da
  • ChemSpider ID24808305

More details:

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

1-(3-Chlorophenyl)-3-{4-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl]-1,3-thiazol-2-yl}urea [ACD/IUPAC Name]
1-(3-Chlorophényl)-3-{4-[2-(thiéno[3,2-d]pyrimidin-4-ylamino)éthyl]-1,3-thiazol-2-yl}urée [French] [ACD/IUPAC Name]
1-(3-Chlorphenyl)-3-{4-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl]-1,3-thiazol-2-yl}harnstoff [German] [ACD/IUPAC Name]
Urea, N-(3-chlorophenyl)-N'-[4-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl]-2-thiazolyl]- [ACD/Index Name]
Kinome_3713

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.815
Molar Refractivity: 117.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.36
ACD/LogD (pH 5.5): 4.29
ACD/BCF (pH 5.5): 750.10
ACD/KOC (pH 5.5): 2595.76
ACD/LogD (pH 7.4): 3.19
ACD/BCF (pH 7.4): 59.48
ACD/KOC (pH 7.4): 205.82
Polar Surface Area: 148 Å2
Polarizability: 46.6±0.5 10-24cm3
Surface Tension: 85.5±3.0 dyne/cm
Molar Volume: 271.2±3.0 cm3

Click to predict properties on the Chemicalize site


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