ChemSpider 2D Image | 1-{5-[2-(Thieno[3,2-d]pyrimidin-4-ylamino)ethyl]-1,3-thiazol-2-yl}-3-[3-(trifluoromethyl)phenyl]urea | C19H15F3N6OS2

1-{5-[2-(Thieno[3,2-d]pyrimidin-4-ylamino)ethyl]-1,3-thiazol-2-yl}-3-[3-(trifluoromethyl)phenyl]urea

  • Molecular FormulaC19H15F3N6OS2
  • Average mass464.487 Da
  • Monoisotopic mass464.070099 Da
  • ChemSpider ID23331485

More details:






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

1-{5-[2-(Thieno[3,2-d]pyrimidin-4-ylamino)ethyl]-1,3-thiazol-2-yl}-3-[3-(trifluormethyl)phenyl]harnstoff [German] [ACD/IUPAC Name]
1-{5-[2-(Thieno[3,2-d]pyrimidin-4-ylamino)ethyl]-1,3-thiazol-2-yl}-3-[3-(trifluoromethyl)phenyl]urea [ACD/IUPAC Name]
1-{5-[2-(Thiéno[3,2-d]pyrimidin-4-ylamino)éthyl]-1,3-thiazol-2-yl}-3-[3-(trifluorométhyl)phényl]urée [French] [ACD/IUPAC Name]
Urea, N-[5-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl]-2-thiazolyl]-N'-[3-(trifluoromethyl)phenyl]- [ACD/Index Name]
1-(5-(2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl)thiazol-2-yl)-3-(3-(trifluoromethyl)phenyl)urea
3-[5-(2-{thieno[3,2-d]pyrimidin-4-ylamino}ethyl)-1,3-thiazol-2-yl]-1-[3-(trifluoromethyl)phenyl]urea
3-{5-[2-({thieno[3,2-d]pyrimidin-4-yl}amino)ethyl]-1,3-thiazol-2-yl}-1-[3-(trifluoromethyl)phenyl]urea
AK1
thieno[3,2-d]pyrimidine analogue, 10

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.737
Molar Refractivity: 117.7±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.69
ACD/LogD (pH 5.5): 4.26
ACD/BCF (pH 5.5): 728.65
ACD/KOC (pH 5.5): 2607.46
ACD/LogD (pH 7.4): 3.15
ACD/BCF (pH 7.4): 56.57
ACD/KOC (pH 7.4): 202.45
Polar Surface Area: 148 Å2
Polarizability: 46.6±0.5 10-24cm3
Surface Tension: 69.7±3.0 dyne/cm
Molar Volume: 292.8±3.0 cm3

Click to predict properties on the Chemicalize site






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