6-bromo-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
6-bromo-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-2-oxo-2H-1-benzopyran-3-carboxamide
6-bromo-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 3382-1233 |
| Compound Name: | 6-bromo-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 441.3 |
| Molecular Formula: | C20 H13 Br N2 O3 S |
| Smiles: | Cc1nc(cs1)c1ccc(cc1)NC(C1=Cc2cc(ccc2OC1=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.8354 |
| logD: | 4.8347 |
| logSw: | -4.7853 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.792 |
| InChI Key: | XQQIMAXPMPSMPX-UHFFFAOYSA-N |