3-[4-(2,5-dimethylphenyl)piperazin-1-yl]-4-phenylcyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-[4-(2,5-dimethylphenyl)piperazin-1-yl]-4-phenylcyclobut-3-ene-1,2-dione
3-[4-(2,5-dimethylphenyl)piperazin-1-yl]-4-phenylcyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E470-0358 |
| Compound Name: | 3-[4-(2,5-dimethylphenyl)piperazin-1-yl]-4-phenylcyclobut-3-ene-1,2-dione |
| Molecular Weight: | 346.43 |
| Molecular Formula: | C22 H22 N2 O2 |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)C1=C(C(C1=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6573 |
| logD: | 4.6573 |
| logSw: | -4.4044 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.113 |
| InChI Key: | NAIKVJOCESJPKO-UHFFFAOYSA-N |