4-{4-[2-(dimethylamino)ethyl]piperidin-1-yl}-5-nitrobenzene-1,2-dicarbonitrile
Chemical Structure Depiction of
4-{4-[2-(dimethylamino)ethyl]piperidin-1-yl}-5-nitrobenzene-1,2-dicarbonitrile
4-{4-[2-(dimethylamino)ethyl]piperidin-1-yl}-5-nitrobenzene-1,2-dicarbonitrile
Compound characteristics
| Compound ID: | 8016-3857 |
| Compound Name: | 4-{4-[2-(dimethylamino)ethyl]piperidin-1-yl}-5-nitrobenzene-1,2-dicarbonitrile |
| Molecular Weight: | 327.38 |
| Molecular Formula: | C17 H21 N5 O2 |
| Smiles: | CN(C)CCC1CCN(CC1)c1cc(C#N)c(C#N)cc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.6621 |
| logD: | 1.0963 |
| logSw: | -3.218 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 74.449 |
| InChI Key: | BGLGTUKDARGOME-UHFFFAOYSA-N |