2-(azepane-1-carbonyl)-N-(2-chloro-4-methylphenyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
Chemical Structure Depiction of
2-(azepane-1-carbonyl)-N-(2-chloro-4-methylphenyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
2-(azepane-1-carbonyl)-N-(2-chloro-4-methylphenyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
Compound characteristics
| Compound ID: | L305-1677 |
| Compound Name: | 2-(azepane-1-carbonyl)-N-(2-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(c(c1)[Cl])NS(c1ccc2c(c1)NC(C(C(N1CCCCCC1)=O)S2)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2928 |
| logD: | 3.4544 |
| logSw: | -4.4252 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.047 |
| InChI Key: | OJRKQKSQEUWSPP-FQEVSTJZSA-N |