3-(3,4-dimethylphenyl)-4-[2-(4-methylpiperazin-1-yl)anilino]cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(3,4-dimethylphenyl)-4-[2-(4-methylpiperazin-1-yl)anilino]cyclobut-3-ene-1,2-dione
3-(3,4-dimethylphenyl)-4-[2-(4-methylpiperazin-1-yl)anilino]cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E470-0746 |
| Compound Name: | 3-(3,4-dimethylphenyl)-4-[2-(4-methylpiperazin-1-yl)anilino]cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 375.47 |
| Molecular Formula: | C23 H25 N3 O2 |
| Smiles: | Cc1ccc(cc1C)C1=C(C(C1=O)=O)Nc1ccccc1N1CCN(C)CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.0897 |
| logD: | 3.6148 |
| logSw: | -4.149 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.825 |
| InChI Key: | LZVJYUPOPDTOTI-UHFFFAOYSA-N |