3-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one
Chemical Structure Depiction of
3-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one
3-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one
Compound characteristics
| Compound ID: | Y040-0846 |
| Compound Name: | 3-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one |
| Molecular Weight: | 369.46 |
| Molecular Formula: | C22 H27 N O4 |
| Smiles: | CC1CCN(CC1)C(COc1ccc2C3CCCCCC=3C(=O)Oc2c1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7586 |
| logD: | 3.7586 |
| logSw: | -3.9174 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.032 |
| InChI Key: | AIFDOAMOLNBGPM-UHFFFAOYSA-N |