2-(azepane-1-carbonyl)-N-(2-ethyl-6-methylphenyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
Chemical Structure Depiction of
2-(azepane-1-carbonyl)-N-(2-ethyl-6-methylphenyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
2-(azepane-1-carbonyl)-N-(2-ethyl-6-methylphenyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
Compound characteristics
| Compound ID: | L305-1706 |
| Compound Name: | 2-(azepane-1-carbonyl)-N-(2-ethyl-6-methylphenyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide |
| Molecular Weight: | 487.64 |
| Molecular Formula: | C24 H29 N3 O4 S2 |
| Smiles: | CCc1cccc(C)c1NS(c1ccc2c(c1)NC(C(C(N1CCCCCC1)=O)S2)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0652 |
| logD: | 4.039 |
| logSw: | -3.9232 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.349 |
| InChI Key: | ACOTZQLBSOAEMQ-QFIPXVFZSA-N |