6-chloro-8-[(2-ethylpiperidin-1-yl)methyl]-7-hydroxy-3,4-dimethyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-chloro-8-[(2-ethylpiperidin-1-yl)methyl]-7-hydroxy-3,4-dimethyl-2H-1-benzopyran-2-one
6-chloro-8-[(2-ethylpiperidin-1-yl)methyl]-7-hydroxy-3,4-dimethyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-1646 |
| Compound Name: | 6-chloro-8-[(2-ethylpiperidin-1-yl)methyl]-7-hydroxy-3,4-dimethyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 349.86 |
| Molecular Formula: | C19 H24 Cl N O3 |
| Smiles: | CCC1CCCCN1Cc1c(c(cc2C(C)=C(C)C(=O)Oc12)[Cl])O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8627 |
| logD: | 4.0148 |
| logSw: | -4.6726 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.868 |
| InChI Key: | RGSPHZMFORVAPR-ZDUSSCGKSA-N |