3-(3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[(pyridin-4-yl)methyl]propanamide
Chemical Structure Depiction of
3-(3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[(pyridin-4-yl)methyl]propanamide
3-(3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[(pyridin-4-yl)methyl]propanamide
Compound characteristics
| Compound ID: | Y041-8329 |
| Compound Name: | 3-(3-oxo-1,2-benzothiazol-2(3H)-yl)-N-[(pyridin-4-yl)methyl]propanamide |
| Molecular Weight: | 313.38 |
| Molecular Formula: | C16 H15 N3 O2 S |
| Smiles: | C(CN1C(c2ccccc2S1)=O)C(NCc1ccncc1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9762 |
| logD: | 0.9728 |
| logSw: | -1.9366 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.505 |
| InChI Key: | UXJFFSUBSMZRTC-UHFFFAOYSA-N |