6-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-4-methyl-2-{[4-(trifluoromethyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
6-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-4-methyl-2-{[4-(trifluoromethyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one
6-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-4-methyl-2-{[4-(trifluoromethyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | C310-3011 |
| Compound Name: | 6-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]-4-methyl-2-{[4-(trifluoromethyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 572.05 |
| Molecular Formula: | C29 H25 Cl F3 N3 O2 S |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)C(c1ccc2c(c1)N(C)C(/C(=C/c1ccc(cc1)C(F)(F)F)S2)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.4813 |
| logD: | 6.4813 |
| logSw: | -6.3845 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.715 |
| InChI Key: | BDURQYQTSDLZQV-UHFFFAOYSA-N |