2-(azepane-1-carbonyl)-N-(3-chloro-4-methylphenyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
Chemical Structure Depiction of
2-(azepane-1-carbonyl)-N-(3-chloro-4-methylphenyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
2-(azepane-1-carbonyl)-N-(3-chloro-4-methylphenyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
Compound characteristics
| Compound ID: | L305-1663 |
| Compound Name: | 2-(azepane-1-carbonyl)-N-(3-chloro-4-methylphenyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide |
| Molecular Weight: | 494.03 |
| Molecular Formula: | C22 H24 Cl N3 O4 S2 |
| Smiles: | Cc1ccc(cc1[Cl])NS(c1ccc2c(c1)NC(C(C(N1CCCCCC1)=O)S2)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7561 |
| logD: | 3.9229 |
| logSw: | -4.7854 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.745 |
| InChI Key: | CSUOELUIWHZJHM-FQEVSTJZSA-N |