6-chloro-8-[(2-ethylpiperidin-1-yl)methyl]-7-hydroxy-4-phenyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-chloro-8-[(2-ethylpiperidin-1-yl)methyl]-7-hydroxy-4-phenyl-2H-1-benzopyran-2-one
6-chloro-8-[(2-ethylpiperidin-1-yl)methyl]-7-hydroxy-4-phenyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-2373 |
| Compound Name: | 6-chloro-8-[(2-ethylpiperidin-1-yl)methyl]-7-hydroxy-4-phenyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 397.9 |
| Molecular Formula: | C23 H24 Cl N O3 |
| Smiles: | CCC1CCCCN1Cc1c(c(cc2C(=CC(=O)Oc12)c1ccccc1)[Cl])O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3483 |
| logD: | 4.8188 |
| logSw: | -5.5351 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.082 |
| InChI Key: | DOFZUJJFKJSWGS-INIZCTEOSA-N |