9-hydroxy-7-methyl-8-[(3-methylpiperidin-1-yl)methyl]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Chemical Structure Depiction of
9-hydroxy-7-methyl-8-[(3-methylpiperidin-1-yl)methyl]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
9-hydroxy-7-methyl-8-[(3-methylpiperidin-1-yl)methyl]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Compound characteristics
| Compound ID: | Y040-2291 |
| Compound Name: | 9-hydroxy-7-methyl-8-[(3-methylpiperidin-1-yl)methyl]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one |
| Molecular Weight: | 327.42 |
| Molecular Formula: | C20 H25 N O3 |
| Smiles: | CC1CCCN(C1)Cc1c(C)cc2c(C3CCCC=3C(=O)O2)c1O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8566 |
| logD: | 2.6698 |
| logSw: | -4.0503 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.592 |
| InChI Key: | LLIYLPUJZHLKKS-LBPRGKRZSA-N |