8-chloro-7-hydroxy-6-[(3-methylpiperidin-1-yl)methyl]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Chemical Structure Depiction of
8-chloro-7-hydroxy-6-[(3-methylpiperidin-1-yl)methyl]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
8-chloro-7-hydroxy-6-[(3-methylpiperidin-1-yl)methyl]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Compound characteristics
Compound ID: | D635-0127 |
Compound Name: | 8-chloro-7-hydroxy-6-[(3-methylpiperidin-1-yl)methyl]-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one |
Molecular Weight: | 347.84 |
Molecular Formula: | C19 H22 Cl N O3 |
Smiles: | CC1CCCN(C1)Cc1c(c(cc2C3CCCC=3C(=O)Oc12)[Cl])O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.2715 |
logD: | 3.6631 |
logSw: | -4.2251 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 40.276 |
InChI Key: | AHKMKPDAZASEIB-NSHDSACASA-N |