6-bromo-4-oxo-N-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
6-bromo-4-oxo-N-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]-4H-1-benzopyran-2-carboxamide
6-bromo-4-oxo-N-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]-4H-1-benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | D523-1720 |
| Compound Name: | 6-bromo-4-oxo-N-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethyl]-4H-1-benzopyran-2-carboxamide |
| Molecular Weight: | 440.25 |
| Molecular Formula: | C20 H14 Br N3 O4 |
| Smiles: | [H]N(CCc1nc(c2ccccc2)no1)C(C1=CC(c2cc(ccc2O1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1681 |
| logD: | 4.1681 |
| logSw: | -4.4073 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.655 |
| InChI Key: | FKSRNKGXPRMWLP-UHFFFAOYSA-N |