3-(1,3-benzothiazol-2-yl)-2-oxo-2H-1-benzopyran-7-yl acetate
Chemical Structure Depiction of
3-(1,3-benzothiazol-2-yl)-2-oxo-2H-1-benzopyran-7-yl acetate
3-(1,3-benzothiazol-2-yl)-2-oxo-2H-1-benzopyran-7-yl acetate
Compound characteristics
| Compound ID: | 3570-0257 |
| Compound Name: | 3-(1,3-benzothiazol-2-yl)-2-oxo-2H-1-benzopyran-7-yl acetate |
| Molecular Weight: | 337.35 |
| Molecular Formula: | C18 H11 N O4 S |
| Smiles: | CC(=O)Oc1ccc2C=C(C(=O)Oc2c1)c1nc2ccccc2s1 |
| Stereo: | ACHIRAL |
| logP: | 3.4105 |
| logD: | 3.4105 |
| logSw: | -3.8789 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.36 |
| InChI Key: | GMHZSJKERJATQD-UHFFFAOYSA-N |