3-(4-{[1-(2-methoxypyrimidin-4-yl)piperidin-4-yl]acetyl}piperazin-1-yl)propanenitrile
Chemical Structure Depiction of
3-(4-{[1-(2-methoxypyrimidin-4-yl)piperidin-4-yl]acetyl}piperazin-1-yl)propanenitrile
3-(4-{[1-(2-methoxypyrimidin-4-yl)piperidin-4-yl]acetyl}piperazin-1-yl)propanenitrile
Compound characteristics
| Compound ID: | T428-0116 |
| Compound Name: | 3-(4-{[1-(2-methoxypyrimidin-4-yl)piperidin-4-yl]acetyl}piperazin-1-yl)propanenitrile |
| Molecular Weight: | 372.47 |
| Molecular Formula: | C19 H28 N6 O2 |
| Smiles: | COc1nccc(n1)N1CCC(CC1)CC(N1CCN(CCC#N)CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2067 |
| logD: | 1.206 |
| logSw: | -1.6932 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 66.905 |
| InChI Key: | BNHPUAIPKZANMP-UHFFFAOYSA-N |