3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxopropanenitrile
Chemical Structure Depiction of
3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxopropanenitrile
3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxopropanenitrile
Compound characteristics
| Compound ID: | Y508-8347 |
| Compound Name: | 3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxopropanenitrile |
| Molecular Weight: | 257.33 |
| Molecular Formula: | C15 H19 N3 O |
| Smiles: | Cc1cccc(c1C)N1CCN(CC1)C(CC#N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0796 |
| logD: | 2.0709 |
| logSw: | -2.1564 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 37.082 |
| InChI Key: | WBCOKKXOBRIOHE-UHFFFAOYSA-N |