4-[(3-methylphenyl)methyl]-3-oxo-N-[(2,4,6-trifluorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
4-[(3-methylphenyl)methyl]-3-oxo-N-[(2,4,6-trifluorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
4-[(3-methylphenyl)methyl]-3-oxo-N-[(2,4,6-trifluorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | C122-0120 |
| Compound Name: | 4-[(3-methylphenyl)methyl]-3-oxo-N-[(2,4,6-trifluorophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 456.49 |
| Molecular Formula: | C24 H19 F3 N2 O2 S |
| Smiles: | Cc1cccc(CN2C(CSc3ccc(cc23)C(NCc2c(cc(cc2F)F)F)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.2947 |
| logD: | 5.2947 |
| logSw: | -5.2261 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.032 |
| InChI Key: | NABHDYRQCOHFDF-UHFFFAOYSA-N |