3-{[3-(4-cyclohexylpiperazin-1-yl)propyl]amino}-4-[4-(propan-2-yl)phenyl]cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-{[3-(4-cyclohexylpiperazin-1-yl)propyl]amino}-4-[4-(propan-2-yl)phenyl]cyclobut-3-ene-1,2-dione
3-{[3-(4-cyclohexylpiperazin-1-yl)propyl]amino}-4-[4-(propan-2-yl)phenyl]cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E511-0987 |
| Compound Name: | 3-{[3-(4-cyclohexylpiperazin-1-yl)propyl]amino}-4-[4-(propan-2-yl)phenyl]cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 423.6 |
| Molecular Formula: | C26 H37 N3 O2 |
| Smiles: | CC(C)c1ccc(cc1)C1=C(C(C1=O)=O)NCCCN1CCN(CC1)C1CCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.2042 |
| logD: | 3.2939 |
| logSw: | -3.8872 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.134 |
| InChI Key: | OCVDTXDNMFLPQV-UHFFFAOYSA-N |