4-(3-oxo-1,2-benzothiazol-2(3H)-yl)-N-(pyridin-3-yl)butanamide
Chemical Structure Depiction of
4-(3-oxo-1,2-benzothiazol-2(3H)-yl)-N-(pyridin-3-yl)butanamide
4-(3-oxo-1,2-benzothiazol-2(3H)-yl)-N-(pyridin-3-yl)butanamide
Compound characteristics
| Compound ID: | Y042-4288 |
| Compound Name: | 4-(3-oxo-1,2-benzothiazol-2(3H)-yl)-N-(pyridin-3-yl)butanamide |
| Molecular Weight: | 313.38 |
| Molecular Formula: | C16 H15 N3 O2 S |
| Smiles: | C(CC(Nc1cccnc1)=O)CN1C(c2ccccc2S1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.179 |
| logD: | 1.1787 |
| logSw: | -1.7627 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.273 |
| InChI Key: | RDNMWSLGLBENBS-UHFFFAOYSA-N |