5-bromo-N-(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-2-methoxybenzamide
Chemical Structure Depiction of
5-bromo-N-(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-2-methoxybenzamide
5-bromo-N-(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-2-methoxybenzamide
Compound characteristics
Compound ID: | C301-7832 |
Compound Name: | 5-bromo-N-(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-2-methoxybenzamide |
Molecular Weight: | 390.19 |
Molecular Formula: | C17 H12 Br N O5 |
Smiles: | COc1ccc(cc1C(NC1=C(c2ccccc2OC1=O)O)=O)[Br] |
Stereo: | ACHIRAL |
logP: | 2.6149 |
logD: | -1.9516 |
logSw: | -3.3043 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 67.152 |
InChI Key: | SARZNLTVIVBTRI-UHFFFAOYSA-N |