5-{2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-oxoethoxy}-3,4,7-trimethyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
5-{2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-oxoethoxy}-3,4,7-trimethyl-2H-1-benzopyran-2-one
5-{2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-oxoethoxy}-3,4,7-trimethyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-5708 |
| Compound Name: | 5-{2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-oxoethoxy}-3,4,7-trimethyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 455.94 |
| Molecular Formula: | C25 H26 Cl N O5 |
| Smiles: | CC1=C(C)c2c(cc(C)cc2OC1=O)OCC(N1CCC(CC1)(c1ccc(cc1)[Cl])O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.819 |
| logD: | 3.819 |
| logSw: | -4.6104 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.701 |
| InChI Key: | YZYPYHXGTUDIIV-UHFFFAOYSA-N |