ChemSpider 2D Image | TERT-BUTYLCHROMENAMIDO FLUOROBENZYL METHANESULFONAMIDE | C22H25FN2O4S

TERT-BUTYLCHROMENAMIDO FLUOROBENZYL METHANESULFONAMIDE

  • Molecular FormulaC22H25FN2O4S
  • Average mass432.508 Da
  • Monoisotopic mass432.151917 Da
  • ChemSpider ID32700905

More details:

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

1225570-30-8 [RN]
2H-1-Benzopyran-3-carboxamide, 7-(1,1-dimethylethyl)-N-[[3-fluoro-4-[(methylsulfonyl)amino]phenyl]methyl]- [ACD/Index Name]
N-{3-Fluor-4-[(methylsulfonyl)amino]benzyl}-7-(2-methyl-2-propanyl)-2H-chromen-3-carboxamid [German] [ACD/IUPAC Name]
N-{3-Fluoro-4-[(methylsulfonyl)amino]benzyl}-7-(2-methyl-2-propanyl)-2H-chromene-3-carboxamide [ACD/IUPAC Name]
N-{3-Fluoro-4-[(méthylsulfonyl)amino]benzyl}-7-(2-méthyl-2-propanyl)-2H-chromène-3-carboxamide [French] [ACD/IUPAC Name]
TERT-BUTYLCHROMENAMIDO FLUOROBENZYL METHANESULFONAMIDE

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

R80G40F5NQ [DBID]
UNII:R80G40F5NQ [DBID]
UNII-R80G40F5NQ [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.602
Molar Refractivity: 113.5±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.84
ACD/LogD (pH 5.5): 3.41
ACD/BCF (pH 5.5): 230.07
ACD/KOC (pH 5.5): 1705.20
ACD/LogD (pH 7.4): 3.30
ACD/BCF (pH 7.4): 178.64
ACD/KOC (pH 7.4): 1324.00
Polar Surface Area: 93 Å2
Polarizability: 45.0±0.5 10-24cm3
Surface Tension: 53.0±3.0 dyne/cm
Molar Volume: 330.7±3.0 cm3

Click to predict properties on the Chemicalize site


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