2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]-N-[(pyridin-3-yl)methyl]acetamide
Chemical Structure Depiction of
2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]-N-[(pyridin-3-yl)methyl]acetamide
2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]-N-[(pyridin-3-yl)methyl]acetamide
Compound characteristics
| Compound ID: | E589-2477 |
| Compound Name: | 2-[3-oxo-6-(pyrrolidine-1-sulfonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]-N-[(pyridin-3-yl)methyl]acetamide |
| Molecular Weight: | 446.55 |
| Molecular Formula: | C20 H22 N4 O4 S2 |
| Smiles: | C1CCN(C1)S(c1ccc2c(c1)N(CC(NCc1cccnc1)=O)C(CS2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2176 |
| logD: | 1.2152 |
| logSw: | -2.0496 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.685 |
| InChI Key: | XKBRURPCFVBVQL-UHFFFAOYSA-N |