3-{[2-(4-benzylpiperazin-1-yl)ethyl]amino}-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-{[2-(4-benzylpiperazin-1-yl)ethyl]amino}-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
3-{[2-(4-benzylpiperazin-1-yl)ethyl]amino}-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E470-0252 |
| Compound Name: | 3-{[2-(4-benzylpiperazin-1-yl)ethyl]amino}-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 389.5 |
| Molecular Formula: | C24 H27 N3 O2 |
| Smiles: | Cc1ccc(cc1)C1=C(C(C1=O)=O)NCCN1CCN(CC1)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.8255 |
| logD: | 2.6726 |
| logSw: | -3.2046 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.581 |
| InChI Key: | HGDFGMOKDHEOJS-UHFFFAOYSA-N |