7-bromo-4-oxo-N-[2-phenyl-2-(piperidin-1-yl)ethyl]-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
7-bromo-4-oxo-N-[2-phenyl-2-(piperidin-1-yl)ethyl]-4H-1-benzopyran-2-carboxamide
7-bromo-4-oxo-N-[2-phenyl-2-(piperidin-1-yl)ethyl]-4H-1-benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | D491-2353 |
| Compound Name: | 7-bromo-4-oxo-N-[2-phenyl-2-(piperidin-1-yl)ethyl]-4H-1-benzopyran-2-carboxamide |
| Molecular Weight: | 455.35 |
| Molecular Formula: | C23 H23 Br N2 O3 |
| Smiles: | [H]N(CC(c1ccccc1)N1CCCCC1)C(C1=CC(c2ccc(cc2O1)[Br])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4274 |
| logD: | 3.9077 |
| logSw: | -4.2861 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.459 |
| InChI Key: | RAIRKJIOJPWFIT-IBGZPJMESA-N |