6-chloro-8-[(2-ethylpiperidin-1-yl)methyl]-7-hydroxy-4-propyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-chloro-8-[(2-ethylpiperidin-1-yl)methyl]-7-hydroxy-4-propyl-2H-1-benzopyran-2-one
6-chloro-8-[(2-ethylpiperidin-1-yl)methyl]-7-hydroxy-4-propyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-1692 |
| Compound Name: | 6-chloro-8-[(2-ethylpiperidin-1-yl)methyl]-7-hydroxy-4-propyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 363.88 |
| Molecular Formula: | C20 H26 Cl N O3 |
| Smiles: | CCCC1=CC(=O)Oc2c1cc(c(c2CN1CCCCC1CC)O)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2666 |
| logD: | 4.4186 |
| logSw: | -5.508 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.354 |
| InChI Key: | YVJZCSTYCGPQEY-AWEZNQCLSA-N |