3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-4-hydroxycyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-4-hydroxycyclobut-3-ene-1,2-dione
3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-4-hydroxycyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | G317-0487 |
| Compound Name: | 3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-4-hydroxycyclobut-3-ene-1,2-dione |
| Molecular Weight: | 286.33 |
| Molecular Formula: | C16 H18 N2 O3 |
| Smiles: | Cc1cccc(c1C)N1CCN(CC1)C1=C(C(C1=O)=O)O |
| Stereo: | ACHIRAL |
| logP: | 2.4797 |
| logD: | -1.8 |
| logSw: | -2.2657 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.456 |
| InChI Key: | ZELYECXUTXLPID-UHFFFAOYSA-N |