3-[4-(4-chlorophenyl)-5-ethyl-1,3-thiazol-2-yl]-2-oxo-2H-1-benzopyran-7-yl acetate
Chemical Structure Depiction of
3-[4-(4-chlorophenyl)-5-ethyl-1,3-thiazol-2-yl]-2-oxo-2H-1-benzopyran-7-yl acetate
3-[4-(4-chlorophenyl)-5-ethyl-1,3-thiazol-2-yl]-2-oxo-2H-1-benzopyran-7-yl acetate
Compound characteristics
| Compound ID: | K277-0148 |
| Compound Name: | 3-[4-(4-chlorophenyl)-5-ethyl-1,3-thiazol-2-yl]-2-oxo-2H-1-benzopyran-7-yl acetate |
| Molecular Weight: | 425.89 |
| Molecular Formula: | C22 H16 Cl N O4 S |
| Smiles: | CCc1c(c2ccc(cc2)[Cl])nc(C2=Cc3ccc(cc3OC2=O)OC(C)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.4764 |
| logD: | 5.4764 |
| logSw: | -6.0156 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.144 |
| InChI Key: | JBFHXTOSDYBZKJ-UHFFFAOYSA-N |