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Search term: ZOTXREFTVLTGPQ-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 4-{[6-(Dimethylamino)-4-pyrimidinyl]amino}-N-{3-[4-fluoro-3-(trifluoromethyl)phenyl]-1,2,4-thiadiazol-5-yl}benzamide | C22H17F4N7OS

4-{[6-(Dimethylamino)-4-pyrimidinyl]amino}-N-{3-[4-fluoro-3-(trifluoromethyl)phenyl]-1,2,4-thiadiazol-5-yl}benzamide

  • Molecular FormulaC22H17F4N7OS
  • Average mass503.475 Da
  • Monoisotopic mass503.115143 Da
  • ChemSpider ID9787818

More details:

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

4-{[6-(Dimethylamino)-4-pyrimidinyl]amino}-N-{3-[4-fluor-3-(trifluormethyl)phenyl]-1,2,4-thiadiazol-5-yl}benzamid [German] [ACD/IUPAC Name]
4-{[6-(Dimethylamino)-4-pyrimidinyl]amino}-N-{3-[4-fluoro-3-(trifluoromethyl)phenyl]-1,2,4-thiadiazol-5-yl}benzamide [ACD/IUPAC Name]
4-{[6-(Diméthylamino)-4-pyrimidinyl]amino}-N-{3-[4-fluoro-3-(trifluorométhyl)phényl]-1,2,4-thiadiazol-5-yl}benzamide [French] [ACD/IUPAC Name]
4-{[6-(dimethylamino)pyrimidin-4-yl]amino}-N-{3-[4-fluoro-3-(trifluoromethyl)phenyl]-1,2,4-thiadiazol-5-yl}benzamide
Benzamide, 4-[[6-(dimethylamino)-4-pyrimidinyl]amino]-N-[3-[4-fluoro-3-(trifluoromethyl)phenyl]-1,2,4-thiadiazol-5-yl]- [ACD/Index Name]
4-(6-(dimethylamino)pyrimidin-4-ylamino)-N-(3-(4-fluoro-3-(trifluoromethyl)phenyl)-1,2,4-thiadiazol-5-yl)benzamide
CHEMBL247240

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.661
Molar Refractivity: 124.8±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 6.42
ACD/LogD (pH 5.5): 4.41
ACD/BCF (pH 5.5): 1017.53
ACD/KOC (pH 5.5): 3654.84
ACD/LogD (pH 7.4): 4.86
ACD/BCF (pH 7.4): 2883.25
ACD/KOC (pH 7.4): 10356.28
Polar Surface Area: 124 Å2
Polarizability: 49.5±0.5 10-24cm3
Surface Tension: 59.9±3.0 dyne/cm
Molar Volume: 337.7±3.0 cm3

Click to predict properties on the Chemicalize site


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