2-(azepane-1-carbonyl)-N-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
Chemical Structure Depiction of
2-(azepane-1-carbonyl)-N-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
2-(azepane-1-carbonyl)-N-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
Compound characteristics
| Compound ID: | L305-1641 |
| Compound Name: | 2-(azepane-1-carbonyl)-N-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide |
| Molecular Weight: | 473.61 |
| Molecular Formula: | C23 H27 N3 O4 S2 |
| Smiles: | Cc1ccc(CNS(c2ccc3c(c2)NC(C(C(N2CCCCCC2)=O)S3)=O)(=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7504 |
| logD: | 3.7499 |
| logSw: | -3.8187 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.854 |
| InChI Key: | BPSHMGNVJWDOQS-NRFANRHFSA-N |