2-{[4-(4-chlorophenyl)piperazin-1-yl]methyl}-5-[2-(morpholin-4-yl)-2-oxoethoxy]-4H-pyran-4-one
Chemical Structure Depiction of
2-{[4-(4-chlorophenyl)piperazin-1-yl]methyl}-5-[2-(morpholin-4-yl)-2-oxoethoxy]-4H-pyran-4-one
2-{[4-(4-chlorophenyl)piperazin-1-yl]methyl}-5-[2-(morpholin-4-yl)-2-oxoethoxy]-4H-pyran-4-one
Compound characteristics
| Compound ID: | IB05-2607 |
| Compound Name: | 2-{[4-(4-chlorophenyl)piperazin-1-yl]methyl}-5-[2-(morpholin-4-yl)-2-oxoethoxy]-4H-pyran-4-one |
| Molecular Weight: | 447.92 |
| Molecular Formula: | C22 H26 Cl N3 O5 |
| Smiles: | C1CN(CCN1CC1=CC(C(=CO1)OCC(N1CCOCC1)=O)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 1.07 |
| logD: | 1.06 |
| logSw: | -2.18 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 114.6 |
| InChI Key: | BTEMUMQTTSWEMR-UHFFFAOYSA-N |