{1-methyl-4-[4-(pyrimidin-2-yl)piperazin-1-yl][1,2,4]triazolo[4,3-a]quinoxalin-8-yl}(phenyl)methanone
Chemical Structure Depiction of
{1-methyl-4-[4-(pyrimidin-2-yl)piperazin-1-yl][1,2,4]triazolo[4,3-a]quinoxalin-8-yl}(phenyl)methanone
{1-methyl-4-[4-(pyrimidin-2-yl)piperazin-1-yl][1,2,4]triazolo[4,3-a]quinoxalin-8-yl}(phenyl)methanone
Compound characteristics
| Compound ID: | E881-0178 |
| Compound Name: | {1-methyl-4-[4-(pyrimidin-2-yl)piperazin-1-yl][1,2,4]triazolo[4,3-a]quinoxalin-8-yl}(phenyl)methanone |
| Molecular Weight: | 450.5 |
| Molecular Formula: | C25 H22 N8 O |
| Smiles: | Cc1nnc2c(nc3ccc(cc3n12)C(c1ccccc1)=O)N1CCN(CC1)c1ncccn1 |
| Stereo: | ACHIRAL |
| logP: | 3.6894 |
| logD: | 3.6894 |
| logSw: | -3.9046 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 69.172 |
| InChI Key: | BPOFFQBVISBMSI-UHFFFAOYSA-N |