N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-oxo-3-[3-oxo-3-(piperidin-1-yl)propyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-oxo-3-[3-oxo-3-(piperidin-1-yl)propyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-oxo-3-[3-oxo-3-(piperidin-1-yl)propyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
Compound characteristics
| Compound ID: | F952-0468 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-oxo-3-[3-oxo-3-(piperidin-1-yl)propyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide |
| Molecular Weight: | 503.6 |
| Molecular Formula: | C23 H25 N3 O6 S2 |
| Smiles: | C1CCN(CC1)C(CCN1C(=O)Sc2cc(ccc12)S(NCc1ccc2c(c1)OCO2)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.408 |
| logD: | 3.4078 |
| logSw: | -3.945 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.056 |
| InChI Key: | VVBPLTMVUQWECU-UHFFFAOYSA-N |