2-{8-[4-(4-methylphenyl)piperazin-1-yl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}-N-[3-(propan-2-yl)phenyl]acetamide
Chemical Structure Depiction of
2-{8-[4-(4-methylphenyl)piperazin-1-yl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}-N-[3-(propan-2-yl)phenyl]acetamide
2-{8-[4-(4-methylphenyl)piperazin-1-yl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}-N-[3-(propan-2-yl)phenyl]acetamide
Compound characteristics
| Compound ID: | M460-4065 |
| Compound Name: | 2-{8-[4-(4-methylphenyl)piperazin-1-yl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}-N-[3-(propan-2-yl)phenyl]acetamide |
| Molecular Weight: | 485.59 |
| Molecular Formula: | C27 H31 N7 O2 |
| Smiles: | CC(C)c1cccc(c1)NC(CN1C(N2C=CN=C(C2=N1)N1CCN(CC1)c1ccc(C)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1843 |
| logD: | 4.1841 |
| logSw: | -4.1706 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.469 |
| InChI Key: | ZFGYEWJDANPWBD-UHFFFAOYSA-N |