2-({[2-(4-hexanoylpiperazin-1-yl)ethyl]amino}methylidene)-5-phenylcyclohexane-1,3-dione
Chemical Structure Depiction of
2-({[2-(4-hexanoylpiperazin-1-yl)ethyl]amino}methylidene)-5-phenylcyclohexane-1,3-dione
2-({[2-(4-hexanoylpiperazin-1-yl)ethyl]amino}methylidene)-5-phenylcyclohexane-1,3-dione
Compound characteristics
| Compound ID: | 4779-0089 |
| Compound Name: | 2-({[2-(4-hexanoylpiperazin-1-yl)ethyl]amino}methylidene)-5-phenylcyclohexane-1,3-dione |
| Molecular Weight: | 425.57 |
| Molecular Formula: | C25 H35 N3 O3 |
| Smiles: | CCCCCC(N1CCN(CCNC=C2C(CC(CC2=O)c2ccccc2)=O)CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5709 |
| logD: | 2.4788 |
| logSw: | -2.8658 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.54 |
| InChI Key: | QCODUYAEJDHWFC-UHFFFAOYSA-N |