(1-methyl-4-{[(pyridin-4-yl)methyl]amino}[1,2,4]triazolo[4,3-a]quinoxalin-8-yl)(phenyl)methanone
Chemical Structure Depiction of
(1-methyl-4-{[(pyridin-4-yl)methyl]amino}[1,2,4]triazolo[4,3-a]quinoxalin-8-yl)(phenyl)methanone
(1-methyl-4-{[(pyridin-4-yl)methyl]amino}[1,2,4]triazolo[4,3-a]quinoxalin-8-yl)(phenyl)methanone
Compound characteristics
| Compound ID: | E881-0218 |
| Compound Name: | (1-methyl-4-{[(pyridin-4-yl)methyl]amino}[1,2,4]triazolo[4,3-a]quinoxalin-8-yl)(phenyl)methanone |
| Molecular Weight: | 394.43 |
| Molecular Formula: | C23 H18 N6 O |
| Smiles: | Cc1nnc2c(NCc3ccncc3)nc3ccc(cc3n12)C(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3966 |
| logD: | 2.3944 |
| logSw: | -2.7682 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.467 |
| InChI Key: | JOTUSMCSKVRZGP-UHFFFAOYSA-N |