3-[2-(2-bromo-4-methylanilino)-1,3-thiazol-4-yl]-6-methoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[2-(2-bromo-4-methylanilino)-1,3-thiazol-4-yl]-6-methoxy-2H-1-benzopyran-2-one
3-[2-(2-bromo-4-methylanilino)-1,3-thiazol-4-yl]-6-methoxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K232-0375 |
| Compound Name: | 3-[2-(2-bromo-4-methylanilino)-1,3-thiazol-4-yl]-6-methoxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 443.32 |
| Molecular Formula: | C20 H15 Br N2 O3 S |
| Smiles: | Cc1ccc(c(c1)[Br])Nc1nc(cs1)C1=Cc2cc(ccc2OC1=O)OC |
| Stereo: | ACHIRAL |
| logP: | 5.7678 |
| logD: | 5.7678 |
| logSw: | -5.5019 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.693 |
| InChI Key: | QGYATHYRSDPOFA-UHFFFAOYSA-N |