N-(3-methylbutyl)-4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
N-(3-methylbutyl)-4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
N-(3-methylbutyl)-4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | C122-0185 |
| Compound Name: | N-(3-methylbutyl)-4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 382.52 |
| Molecular Formula: | C22 H26 N2 O2 S |
| Smiles: | CC(C)CCNC(c1ccc2c(c1)N(Cc1ccc(C)cc1)C(CS2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4194 |
| logD: | 4.4194 |
| logSw: | -4.1289 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.145 |
| InChI Key: | FIXXQDGXSITXEW-UHFFFAOYSA-N |