methyl 8-[4-({5-[(3,5-dimethylphenyl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)piperazin-1-yl]-8-oxooctanoate
Chemical Structure Depiction of
methyl 8-[4-({5-[(3,5-dimethylphenyl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)piperazin-1-yl]-8-oxooctanoate
methyl 8-[4-({5-[(3,5-dimethylphenyl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)piperazin-1-yl]-8-oxooctanoate
Compound characteristics
| Compound ID: | V006-7637 |
| Compound Name: | methyl 8-[4-({5-[(3,5-dimethylphenyl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)piperazin-1-yl]-8-oxooctanoate |
| Molecular Weight: | 498.62 |
| Molecular Formula: | C28 H38 N2 O6 |
| Salt: | not_available |
| Smiles: | Cc1cc(C)cc(COC2=COC(CN3CCN(CC3)C(CCCCCCC(=O)OC)=O)=CC2=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.6843 |
| logD: | 3.6835 |
| logSw: | -3.8538 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 70.662 |
| InChI Key: | KPPKDLPTDGVJQT-UHFFFAOYSA-N |