2-({[2-(4-benzoylpiperazin-1-yl)ethyl]amino}methylidene)-5-(furan-2-yl)cyclohexane-1,3-dione
Chemical Structure Depiction of
2-({[2-(4-benzoylpiperazin-1-yl)ethyl]amino}methylidene)-5-(furan-2-yl)cyclohexane-1,3-dione
2-({[2-(4-benzoylpiperazin-1-yl)ethyl]amino}methylidene)-5-(furan-2-yl)cyclohexane-1,3-dione
Compound characteristics
| Compound ID: | 4038-0103 |
| Compound Name: | 2-({[2-(4-benzoylpiperazin-1-yl)ethyl]amino}methylidene)-5-(furan-2-yl)cyclohexane-1,3-dione |
| Molecular Weight: | 421.5 |
| Molecular Formula: | C24 H27 N3 O4 |
| Smiles: | C1C(CC(C(=CNCCN2CCN(CC2)C(c2ccccc2)=O)C1=O)=O)c1ccco1 |
| Stereo: | ACHIRAL |
| logP: | 1.0121 |
| logD: | 0.9672 |
| logSw: | -1.6089 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.374 |
| InChI Key: | IYKPNDMBTZHXDS-UHFFFAOYSA-N |