N-(5-chloropyridin-2-yl)-3-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)propanamide
Chemical Structure Depiction of
N-(5-chloropyridin-2-yl)-3-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)propanamide
N-(5-chloropyridin-2-yl)-3-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)propanamide
Compound characteristics
| Compound ID: | E589-0833 |
| Compound Name: | N-(5-chloropyridin-2-yl)-3-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonyl)propanamide |
| Molecular Weight: | 439.94 |
| Molecular Formula: | C18 H18 Cl N3 O4 S2 |
| Smiles: | CCC1C(Nc2cc(ccc2S1)S(CCC(Nc1ccc(cn1)[Cl])=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1476 |
| logD: | 3.0626 |
| logSw: | -3.5314 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.735 |
| InChI Key: | HRVONZRBTXQTNX-CQSZACIVSA-N |