6-{[butyl(ethyl)amino]methyl}-7-hydroxy-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Chemical Structure Depiction of
6-{[butyl(ethyl)amino]methyl}-7-hydroxy-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
6-{[butyl(ethyl)amino]methyl}-7-hydroxy-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one
Compound characteristics
| Compound ID: | 3230-2911 |
| Compound Name: | 6-{[butyl(ethyl)amino]methyl}-7-hydroxy-2,3-dihydrobenzo[b]cyclopenta[d]pyran-4(1H)-one |
| Molecular Weight: | 315.41 |
| Molecular Formula: | C19 H25 N O3 |
| Smiles: | CCCCN(CC)Cc1c(ccc2C3CCCC=3C(=O)Oc12)O |
| Stereo: | ACHIRAL |
| logP: | 3.8003 |
| logD: | 2.7803 |
| logSw: | -3.5979 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.365 |
| InChI Key: | VQYGYMGZYBFTEE-UHFFFAOYSA-N |