3-(1,3-benzothiazol-2-yl)-7-hydroxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(1,3-benzothiazol-2-yl)-7-hydroxy-2H-1-benzopyran-2-one
3-(1,3-benzothiazol-2-yl)-7-hydroxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K259-0006 |
| Compound Name: | 3-(1,3-benzothiazol-2-yl)-7-hydroxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 295.31 |
| Molecular Formula: | C16 H9 N O3 S |
| Smiles: | C1=C(C(=O)Oc2cc(ccc12)O)c1nc2ccccc2s1 |
| Stereo: | ACHIRAL |
| logP: | 3.4632 |
| logD: | 3.3904 |
| logSw: | -3.9093 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.226 |
| InChI Key: | CYONGLVNBSZCQH-UHFFFAOYSA-N |