6,8-dibromo-N-(4-methoxyphenyl)-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
6,8-dibromo-N-(4-methoxyphenyl)-2-oxo-2H-1-benzopyran-3-carboxamide
6,8-dibromo-N-(4-methoxyphenyl)-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 8006-5305 |
| Compound Name: | 6,8-dibromo-N-(4-methoxyphenyl)-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 453.08 |
| Molecular Formula: | C17 H11 Br2 N O4 |
| Smiles: | COc1ccc(cc1)NC(C1=Cc2cc(cc(c2OC1=O)[Br])[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5916 |
| logD: | 4.5887 |
| logSw: | -4.557 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.479 |
| InChI Key: | BXUFGYZRGJZIQR-UHFFFAOYSA-N |