N-{[4-(diethylamino)phenyl]methyl}-7-methyl-4-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide
Chemical Structure Depiction of
N-{[4-(diethylamino)phenyl]methyl}-7-methyl-4-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide
N-{[4-(diethylamino)phenyl]methyl}-7-methyl-4-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide
Compound characteristics
| Compound ID: | P516-0629 |
| Compound Name: | N-{[4-(diethylamino)phenyl]methyl}-7-methyl-4-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide |
| Molecular Weight: | 404.47 |
| Molecular Formula: | C22 H24 N6 O2 |
| Smiles: | CCN(CC)c1ccc(CNC(c2c3C(Nc4cc(C)ccc4n3nn2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.7974 |
| logD: | 2.4929 |
| logSw: | -3.206 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.407 |
| InChI Key: | KBVIXGPBNTVVBF-UHFFFAOYSA-N |