5-(4-chlorophenyl)-2-({[2-(4-hexanoylpiperazin-1-yl)ethyl]amino}methylidene)cyclohexane-1,3-dione
Chemical Structure Depiction of
5-(4-chlorophenyl)-2-({[2-(4-hexanoylpiperazin-1-yl)ethyl]amino}methylidene)cyclohexane-1,3-dione
5-(4-chlorophenyl)-2-({[2-(4-hexanoylpiperazin-1-yl)ethyl]amino}methylidene)cyclohexane-1,3-dione
Compound characteristics
| Compound ID: | 4779-0087 |
| Compound Name: | 5-(4-chlorophenyl)-2-({[2-(4-hexanoylpiperazin-1-yl)ethyl]amino}methylidene)cyclohexane-1,3-dione |
| Molecular Weight: | 460.02 |
| Molecular Formula: | C25 H34 Cl N3 O3 |
| Smiles: | CCCCCC(N1CCN(CCNC=C2C(CC(CC2=O)c2ccc(cc2)[Cl])=O)CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1613 |
| logD: | 3.0693 |
| logSw: | -3.7434 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.54 |
| InChI Key: | LFSJLFPOLVLSPK-UHFFFAOYSA-N |