3-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one
3-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K277-0115 |
| Compound Name: | 3-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 398.28 |
| Molecular Formula: | C19 H12 Br N O2 S |
| Smiles: | Cc1c(c2ccc(cc2)[Br])nc(C2=Cc3ccccc3OC2=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.6056 |
| logD: | 5.6056 |
| logSw: | -5.624 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.3929 |
| InChI Key: | QHZRRTIUYPUEHX-UHFFFAOYSA-N |