1-{4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]piperazin-1-yl}but-2-yn-1-one
Chemical Structure Depiction of
1-{4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]piperazin-1-yl}but-2-yn-1-one
1-{4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]piperazin-1-yl}but-2-yn-1-one
Compound characteristics
| Compound ID: | T001-1453 |
| Compound Name: | 1-{4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]piperazin-1-yl}but-2-yn-1-one |
| Molecular Weight: | 292.38 |
| Molecular Formula: | C15 H24 N4 O2 |
| Smiles: | CC#CC(N1CCN(CC1)CC(N1CCN(C)CC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.6815 |
| logD: | -0.8122 |
| logSw: | 0.2531 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.04 |
| InChI Key: | PRQXTIJUCAYHEK-UHFFFAOYSA-N |