6-bromo-3-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-bromo-3-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one
6-bromo-3-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K277-0060 |
| Compound Name: | 6-bromo-3-[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 412.3 |
| Molecular Formula: | C20 H14 Br N O2 S |
| Smiles: | Cc1ccc(C)c(c1)c1csc(C2=Cc3cc(ccc3OC2=O)[Br])n1 |
| Stereo: | ACHIRAL |
| logP: | 6.0687 |
| logD: | 6.0687 |
| logSw: | -5.507 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 30.6225 |
| InChI Key: | GUPRXWZYZIVCCO-UHFFFAOYSA-N |