3-(4-{N-[2-(3-methylphenyl)imidazo[1,2-a]pyrazin-3-yl]-beta-alanyl}piperazin-1-yl)propanenitrile
Chemical Structure Depiction of
3-(4-{N-[2-(3-methylphenyl)imidazo[1,2-a]pyrazin-3-yl]-beta-alanyl}piperazin-1-yl)propanenitrile
3-(4-{N-[2-(3-methylphenyl)imidazo[1,2-a]pyrazin-3-yl]-beta-alanyl}piperazin-1-yl)propanenitrile
Compound characteristics
| Compound ID: | P349-1947 |
| Compound Name: | 3-(4-{N-[2-(3-methylphenyl)imidazo[1,2-a]pyrazin-3-yl]-beta-alanyl}piperazin-1-yl)propanenitrile |
| Molecular Weight: | 417.51 |
| Molecular Formula: | C23 H27 N7 O |
| Smiles: | Cc1cccc(c1)c1c(NCCC(N2CCN(CCC#N)CC2)=O)n2ccncc2n1 |
| Stereo: | ACHIRAL |
| logP: | 1.1213 |
| logD: | 1.1206 |
| logSw: | -1.5128 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.035 |
| InChI Key: | QUKBHYYVRQUWER-UHFFFAOYSA-N |