3-(1,3-benzothiazol-2-yl)-2,8-dimethyl-4-oxo-4H-1-benzopyran-7-yl furan-2-carboxylate
Chemical Structure Depiction of
3-(1,3-benzothiazol-2-yl)-2,8-dimethyl-4-oxo-4H-1-benzopyran-7-yl furan-2-carboxylate
3-(1,3-benzothiazol-2-yl)-2,8-dimethyl-4-oxo-4H-1-benzopyran-7-yl furan-2-carboxylate
Compound characteristics
| Compound ID: | 5084-0049 |
| Compound Name: | 3-(1,3-benzothiazol-2-yl)-2,8-dimethyl-4-oxo-4H-1-benzopyran-7-yl furan-2-carboxylate |
| Molecular Weight: | 417.44 |
| Molecular Formula: | C23 H15 N O5 S |
| Smiles: | CC1=C(C(c2ccc(c(C)c2O1)OC(c1ccco1)=O)=O)c1nc2ccccc2s1 |
| Stereo: | ACHIRAL |
| logP: | 4.8284 |
| logD: | 4.8284 |
| logSw: | -4.7766 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.773 |
| InChI Key: | VUDDYUXFAORJLH-UHFFFAOYSA-N |