4-methyl-6-[3-methyl-4-(4-methylphenyl)piperazine-1-carbonyl]-2-{[4-(trifluoromethyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
4-methyl-6-[3-methyl-4-(4-methylphenyl)piperazine-1-carbonyl]-2-{[4-(trifluoromethyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one
4-methyl-6-[3-methyl-4-(4-methylphenyl)piperazine-1-carbonyl]-2-{[4-(trifluoromethyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | C310-3033 |
| Compound Name: | 4-methyl-6-[3-methyl-4-(4-methylphenyl)piperazine-1-carbonyl]-2-{[4-(trifluoromethyl)phenyl]methylidene}-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 551.63 |
| Molecular Formula: | C30 H28 F3 N3 O2 S |
| Smiles: | CC1CN(CCN1c1ccc(C)cc1)C(c1ccc2c(c1)N(C)C(/C(=C/c1ccc(cc1)C(F)(F)F)S2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.9366 |
| logD: | 5.9366 |
| logSw: | -5.4843 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.234 |
| InChI Key: | KZPIYUIPYQZQDR-FQEVSTJZSA-N |