2-({4-[(benzyloxy)acetyl]piperazin-1-yl}methyl)-5-[(3,5-dimethylphenyl)methoxy]-4H-pyran-4-one
Chemical Structure Depiction of
2-({4-[(benzyloxy)acetyl]piperazin-1-yl}methyl)-5-[(3,5-dimethylphenyl)methoxy]-4H-pyran-4-one
2-({4-[(benzyloxy)acetyl]piperazin-1-yl}methyl)-5-[(3,5-dimethylphenyl)methoxy]-4H-pyran-4-one
Compound characteristics
| Compound ID: | V008-0787 |
| Compound Name: | 2-({4-[(benzyloxy)acetyl]piperazin-1-yl}methyl)-5-[(3,5-dimethylphenyl)methoxy]-4H-pyran-4-one |
| Molecular Weight: | 476.57 |
| Molecular Formula: | C28 H32 N2 O5 |
| Salt: | not_available |
| Smiles: | Cc1cc(C)cc(COC2=COC(CN3CCN(CC3)C(COCc3ccccc3)=O)=CC2=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.5157 |
| logD: | 3.5151 |
| logSw: | -3.5895 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.246 |
| InChI Key: | QJZOTWFPWPOOOS-UHFFFAOYSA-N |