5-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxalin-4(5H)-one
Chemical Structure Depiction of
5-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxalin-4(5H)-one
5-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxalin-4(5H)-one
Compound characteristics
| Compound ID: | F417-0628 |
| Compound Name: | 5-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-1-(propan-2-yl)[1,2,4]triazolo[4,3-a]quinoxalin-4(5H)-one |
| Molecular Weight: | 448.5 |
| Molecular Formula: | C24 H25 F N6 O2 |
| Smiles: | CC(C)c1nnc2C(N(CC(N3CCN(CC3)c3ccc(cc3)F)=O)c3ccccc3n12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3781 |
| logD: | 2.3781 |
| logSw: | -2.5555 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 59.024 |
| InChI Key: | BHVNILMBUPNFIW-UHFFFAOYSA-N |