3-(1,3-benzothiazol-2-yl)-6-ethyl-4-oxo-4H-1-benzopyran-7-yl acetate
Chemical Structure Depiction of
3-(1,3-benzothiazol-2-yl)-6-ethyl-4-oxo-4H-1-benzopyran-7-yl acetate
3-(1,3-benzothiazol-2-yl)-6-ethyl-4-oxo-4H-1-benzopyran-7-yl acetate
Compound characteristics
| Compound ID: | 3570-0097 |
| Compound Name: | 3-(1,3-benzothiazol-2-yl)-6-ethyl-4-oxo-4H-1-benzopyran-7-yl acetate |
| Molecular Weight: | 365.41 |
| Molecular Formula: | C20 H15 N O4 S |
| Smiles: | CCc1cc2C(C(=COc2cc1OC(C)=O)c1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2682 |
| logD: | 4.2682 |
| logSw: | -4.3933 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.418 |
| InChI Key: | TVGLQJDNISRITO-UHFFFAOYSA-N |