8-[(dimethylamino)methyl]-7-hydroxy-6-methyl-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Chemical Structure Depiction of
8-[(dimethylamino)methyl]-7-hydroxy-6-methyl-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
8-[(dimethylamino)methyl]-7-hydroxy-6-methyl-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Compound characteristics
| Compound ID: | Y040-1640 |
| Compound Name: | 8-[(dimethylamino)methyl]-7-hydroxy-6-methyl-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one |
| Molecular Weight: | 273.33 |
| Molecular Formula: | C16 H19 N O3 |
| Smiles: | Cc1c(c(CN(C)C)cc2C3CCCC=3C(=O)Oc12)O |
| Stereo: | ACHIRAL |
| logP: | 2.4625 |
| logD: | 0.9227 |
| logSw: | -2.6335 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.497 |
| InChI Key: | HPSVDFHCIGSTIA-UHFFFAOYSA-N |