3-[4-(3-{1-[6-(propylamino)pyrimidin-4-yl]piperidin-4-yl}propanoyl)piperazin-1-yl]propanenitrile
Chemical Structure Depiction of
3-[4-(3-{1-[6-(propylamino)pyrimidin-4-yl]piperidin-4-yl}propanoyl)piperazin-1-yl]propanenitrile
3-[4-(3-{1-[6-(propylamino)pyrimidin-4-yl]piperidin-4-yl}propanoyl)piperazin-1-yl]propanenitrile
Compound characteristics
| Compound ID: | T422-0803 |
| Compound Name: | 3-[4-(3-{1-[6-(propylamino)pyrimidin-4-yl]piperidin-4-yl}propanoyl)piperazin-1-yl]propanenitrile |
| Molecular Weight: | 413.57 |
| Molecular Formula: | C22 H35 N7 O |
| Smiles: | CCCNc1cc(ncn1)N1CCC(CCC(N2CCN(CCC#N)CC2)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 2.3452 |
| logD: | 2.338 |
| logSw: | -2.6068 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.282 |
| InChI Key: | GMFQVSVVWZZABD-UHFFFAOYSA-N |