6-bromo-N-(4-iodophenyl)-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
6-bromo-N-(4-iodophenyl)-2-oxo-2H-1-benzopyran-3-carboxamide
6-bromo-N-(4-iodophenyl)-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 0848-0094 |
| Compound Name: | 6-bromo-N-(4-iodophenyl)-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 470.06 |
| Molecular Formula: | C16 H9 Br I N O3 |
| Smiles: | C1=C(C(Nc2ccc(cc2)I)=O)C(=O)Oc2ccc(cc12)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.8277 |
| logD: | 4.7496 |
| logSw: | -5.0017 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.251 |
| InChI Key: | OXYIPHPPQOOPPM-UHFFFAOYSA-N |