3-hydroxy-4-[(piperidin-1-yl)methyl]-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one
Chemical Structure Depiction of
3-hydroxy-4-[(piperidin-1-yl)methyl]-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one
3-hydroxy-4-[(piperidin-1-yl)methyl]-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one
Compound characteristics
| Compound ID: | D635-0029 |
| Compound Name: | 3-hydroxy-4-[(piperidin-1-yl)methyl]-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one |
| Molecular Weight: | 327.42 |
| Molecular Formula: | C20 H25 N O3 |
| Smiles: | C1CCC2=C(CC1)c1ccc(c(CN3CCCCC3)c1OC2=O)O |
| Stereo: | ACHIRAL |
| logP: | 4.2168 |
| logD: | 3.2832 |
| logSw: | -3.9256 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.377 |
| InChI Key: | GGUZEBCHMIFFJH-UHFFFAOYSA-N |