3-bromo-N-(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-4-methoxybenzamide
Chemical Structure Depiction of
3-bromo-N-(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-4-methoxybenzamide
3-bromo-N-(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-4-methoxybenzamide
Compound characteristics
| Compound ID: | C301-7830 |
| Compound Name: | 3-bromo-N-(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-4-methoxybenzamide |
| Molecular Weight: | 390.19 |
| Molecular Formula: | C17 H12 Br N O5 |
| Smiles: | COc1ccc(cc1[Br])C(NC1=C(c2ccccc2OC1=O)O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3927 |
| logD: | -2.1738 |
| logSw: | -3.1583 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.152 |
| InChI Key: | IGKFTGXKDGRQCA-UHFFFAOYSA-N |