5-(furan-2-yl)-2-({[2-(4-hexanoylpiperazin-1-yl)ethyl]amino}methylidene)cyclohexane-1,3-dione
Chemical Structure Depiction of
5-(furan-2-yl)-2-({[2-(4-hexanoylpiperazin-1-yl)ethyl]amino}methylidene)cyclohexane-1,3-dione
5-(furan-2-yl)-2-({[2-(4-hexanoylpiperazin-1-yl)ethyl]amino}methylidene)cyclohexane-1,3-dione
Compound characteristics
Compound ID: | 4779-0101 |
Compound Name: | 5-(furan-2-yl)-2-({[2-(4-hexanoylpiperazin-1-yl)ethyl]amino}methylidene)cyclohexane-1,3-dione |
Molecular Weight: | 415.53 |
Molecular Formula: | C23 H33 N3 O4 |
Smiles: | CCCCCC(N1CCN(CCNC=C2C(CC(CC2=O)c2ccco2)=O)CC1)=O |
Stereo: | ACHIRAL |
logP: | 1.6848 |
logD: | 1.5927 |
logSw: | -1.9474 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 68.118 |
InChI Key: | IVWUDBQLFPZGFL-UHFFFAOYSA-N |