3-(4-{N-[2-(3-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-beta-alanyl}piperazin-1-yl)propanenitrile
Chemical Structure Depiction of
3-(4-{N-[2-(3-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-beta-alanyl}piperazin-1-yl)propanenitrile
3-(4-{N-[2-(3-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-beta-alanyl}piperazin-1-yl)propanenitrile
Compound characteristics
| Compound ID: | P349-3478 |
| Compound Name: | 3-(4-{N-[2-(3-fluorophenyl)imidazo[1,2-a]pyrazin-3-yl]-beta-alanyl}piperazin-1-yl)propanenitrile |
| Molecular Weight: | 421.48 |
| Molecular Formula: | C22 H24 F N7 O |
| Smiles: | C(CN1CCN(CC1)C(CCNc1c(c2cccc(c2)F)nc2cnccn12)=O)C#N |
| Stereo: | ACHIRAL |
| logP: | 0.873 |
| logD: | 0.8723 |
| logSw: | -1.3493 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.035 |
| InChI Key: | ADXCOFKXFMIZSB-UHFFFAOYSA-N |