N-[(3-methoxyphenyl)methyl]-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide
Chemical Structure Depiction of
N-[(3-methoxyphenyl)methyl]-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide
N-[(3-methoxyphenyl)methyl]-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide
Compound characteristics
| Compound ID: | E589-2581 |
| Compound Name: | N-[(3-methoxyphenyl)methyl]-2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide |
| Molecular Weight: | 475.58 |
| Molecular Formula: | C22 H25 N3 O5 S2 |
| Smiles: | COc1cccc(CNC(CN2C(CSc3ccc(cc23)S(N2CCCC2)(=O)=O)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.5426 |
| logD: | 2.5426 |
| logSw: | -2.8087 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.711 |
| InChI Key: | QSYIWEJRESXRAD-UHFFFAOYSA-N |