N-(2-methylcyclohexyl)-2-[(2E)-3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide
Chemical Structure Depiction of
N-(2-methylcyclohexyl)-2-[(2E)-3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide
N-(2-methylcyclohexyl)-2-[(2E)-3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide
Compound characteristics
Compound ID: | C312-1642 |
Compound Name: | N-(2-methylcyclohexyl)-2-[(2E)-3-oxo-2-{[4-(trifluoromethyl)phenyl]methylidene}-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide |
Molecular Weight: | 474.54 |
Molecular Formula: | C25 H25 F3 N2 O2 S |
Smiles: | CC1CCCCC1NC(CN1C(/C(=C\c2ccc(cc2)C(F)(F)F)Sc2ccccc12)=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 6.0901 |
logD: | 6.0901 |
logSw: | -5.5752 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 39.656 |
InChI Key: | AIPOVPIEHNUSAD-UHFFFAOYSA-N |