6,8-dibromo-3-[2-(4-methylanilino)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6,8-dibromo-3-[2-(4-methylanilino)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one
6,8-dibromo-3-[2-(4-methylanilino)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 8007-0563 |
| Compound Name: | 6,8-dibromo-3-[2-(4-methylanilino)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 492.19 |
| Molecular Formula: | C19 H12 Br2 N2 O2 S |
| Smiles: | Cc1ccc(cc1)Nc1nc(cs1)C1=Cc2cc(cc(c2OC1=O)[Br])[Br] |
| Stereo: | ACHIRAL |
| logP: | 6.8772 |
| logD: | 6.8772 |
| logSw: | -5.672 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.532 |
| InChI Key: | DUZFGMQZCNGENX-UHFFFAOYSA-N |