4-methyl-3-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one
Chemical Structure Depiction of
4-methyl-3-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one
4-methyl-3-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one
Compound characteristics
| Compound ID: | Y040-0877 |
| Compound Name: | 4-methyl-3-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one |
| Molecular Weight: | 383.49 |
| Molecular Formula: | C23 H29 N O4 |
| Smiles: | CC1CCN(CC1)C(COc1ccc2C3CCCCCC=3C(=O)Oc2c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2909 |
| logD: | 4.2909 |
| logSw: | -4.3162 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.803 |
| InChI Key: | HTFDNFTUTBQEND-UHFFFAOYSA-N |