6-bromo-3-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-bromo-3-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one
6-bromo-3-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K277-0122 |
| Compound Name: | 6-bromo-3-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 412.3 |
| Molecular Formula: | C20 H14 Br N O2 S |
| Smiles: | Cc1ccc(cc1)c1c(C)sc(C2=Cc3cc(ccc3OC2=O)[Br])n1 |
| Stereo: | ACHIRAL |
| logP: | 5.9344 |
| logD: | 5.9344 |
| logSw: | -5.5938 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.3929 |
| InChI Key: | YMJUGQZPXALWIJ-UHFFFAOYSA-N |