7-methyl-4-oxo-N-{[4-(propan-2-yl)phenyl]methyl}-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide
Chemical Structure Depiction of
7-methyl-4-oxo-N-{[4-(propan-2-yl)phenyl]methyl}-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide
7-methyl-4-oxo-N-{[4-(propan-2-yl)phenyl]methyl}-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide
Compound characteristics
| Compound ID: | P516-0628 |
| Compound Name: | 7-methyl-4-oxo-N-{[4-(propan-2-yl)phenyl]methyl}-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide |
| Molecular Weight: | 375.43 |
| Molecular Formula: | C21 H21 N5 O2 |
| Smiles: | CC(C)c1ccc(CNC(c2c3C(Nc4cc(C)ccc4n3nn2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.3251 |
| logD: | 3.306 |
| logSw: | -3.4873 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.671 |
| InChI Key: | KIFSBGMTIJDIGB-UHFFFAOYSA-N |