6-bromo-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-bromo-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one
6-bromo-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K234-0017 |
| Compound Name: | 6-bromo-3-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 418.69 |
| Molecular Formula: | C18 H9 Br Cl N O2 S |
| Smiles: | C1=C(C(=O)Oc2ccc(cc12)[Br])c1csc(c2ccc(cc2)[Cl])n1 |
| Stereo: | ACHIRAL |
| logP: | 5.8678 |
| logD: | 5.8678 |
| logSw: | -6.2603 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 30.6225 |
| InChI Key: | VUGLPIVVSXPIFS-UHFFFAOYSA-N |