benzyl 2-[(6-methyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]propanoate
Chemical Structure Depiction of
benzyl 2-[(6-methyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]propanoate
benzyl 2-[(6-methyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]propanoate
Compound characteristics
| Compound ID: | 4789-5242 |
| Compound Name: | benzyl 2-[(6-methyl-4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]propanoate |
| Molecular Weight: | 378.42 |
| Molecular Formula: | C23 H22 O5 |
| Smiles: | CC(C(=O)OCc1ccccc1)Oc1ccc2C3CCCC=3C(=O)Oc2c1C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4806 |
| logD: | 4.4806 |
| logSw: | -4.7294 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.864 |
| InChI Key: | QSAFZFKBCNCDHV-HNNXBMFYSA-N |