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Search term: IIKOGUBERFKZGT (Found by InChIKey (skeleton match))

ChemSpider 2D Image | N-{7-Cyano-6-[4-fluoro-3-({[3-(trifluoromethyl)phenyl]carbamoyl}amino)phenoxy]-1,3-benzothiazol-2-yl}cyclopropanecarboxamide | C26H17F4N5O3S

N-{7-Cyano-6-[4-fluoro-3-({[3-(trifluoromethyl)phenyl]carbamoyl}amino)phenoxy]-1,3-benzothiazol-2-yl}cyclopropanecarboxamide

  • Molecular FormulaC26H17F4N5O3S
  • Average mass555.503 Da
  • Monoisotopic mass555.098816 Da
  • ChemSpider ID31133756

More details:






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

Cyclopropanecarboxamide, N-[7-cyano-6-[4-fluoro-3-[[[[3-(trifluoromethyl)phenyl]amino]carbonyl]amino]phenoxy]-2-benzothiazolyl]- [ACD/Index Name]
N-{7-Cyan-6-[4-fluor-3-({[3-(trifluormethyl)phenyl]carbamoyl}amino)phenoxy]-1,3-benzothiazol-2-yl}cyclopropancarboxamid [German] [ACD/IUPAC Name]
N-{7-Cyano-6-[4-fluoro-3-({[3-(trifluoromethyl)phenyl]carbamoyl}amino)phenoxy]-1,3-benzothiazol-2-yl}cyclopropanecarboxamide [ACD/IUPAC Name]
N-{7-Cyano-6-[4-fluoro-3-({[3-(trifluorométhyl)phényl]carbamoyl}amino)phénoxy]-1,3-benzothiazol-2-yl}cyclopropanecarboxamide [French] [ACD/IUPAC Name]
1SW

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: 1.674
Molar Refractivity: 133.3±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 6.47
ACD/LogD (pH 5.5): 5.50
ACD/BCF (pH 5.5): 8875.01
ACD/KOC (pH 5.5): 23317.32
ACD/LogD (pH 7.4): 5.49
ACD/BCF (pH 7.4): 8815.72
ACD/KOC (pH 7.4): 23161.55
Polar Surface Area: 144 Å2
Polarizability: 52.9±0.5 10-24cm3
Surface Tension: 71.9±5.0 dyne/cm
Molar Volume: 355.2±5.0 cm3

Click to predict properties on the Chemicalize site






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