6,8-dibromo-2-oxo-N-(4-phenoxyphenyl)-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
6,8-dibromo-2-oxo-N-(4-phenoxyphenyl)-2H-1-benzopyran-3-carboxamide
6,8-dibromo-2-oxo-N-(4-phenoxyphenyl)-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | K219-1261 |
| Compound Name: | 6,8-dibromo-2-oxo-N-(4-phenoxyphenyl)-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 515.16 |
| Molecular Formula: | C22 H13 Br2 N O4 |
| Smiles: | C1=C(C(Nc2ccc(cc2)Oc2ccccc2)=O)C(=O)Oc2c1cc(cc2[Br])[Br] |
| Stereo: | ACHIRAL |
| logP: | 6.2993 |
| logD: | 6.2974 |
| logSw: | -6.0452 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.683 |
| InChI Key: | KPLSVPUSBONUAY-UHFFFAOYSA-N |