6,8-dibromo-3-[2-(2-methylanilino)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6,8-dibromo-3-[2-(2-methylanilino)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one
6,8-dibromo-3-[2-(2-methylanilino)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 1636-0345 |
| Compound Name: | 6,8-dibromo-3-[2-(2-methylanilino)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 492.19 |
| Molecular Formula: | C19 H12 Br2 N2 O2 S |
| Smiles: | Cc1ccccc1Nc1nc(cs1)C1=Cc2cc(cc(c2OC1=O)[Br])[Br] |
| Stereo: | ACHIRAL |
| logP: | 6.5081 |
| logD: | 6.5081 |
| logSw: | -5.6641 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.834 |
| InChI Key: | DNULCLUJDTWHOG-UHFFFAOYSA-N |