N-[(2-methylphenyl)methyl]-4-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide
Chemical Structure Depiction of
N-[(2-methylphenyl)methyl]-4-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide
N-[(2-methylphenyl)methyl]-4-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide
Compound characteristics
| Compound ID: | P516-0062 |
| Compound Name: | N-[(2-methylphenyl)methyl]-4-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide |
| Molecular Weight: | 333.35 |
| Molecular Formula: | C18 H15 N5 O2 |
| Smiles: | Cc1ccccc1CNC(c1c2C(Nc3ccccc3n2nn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5387 |
| logD: | 2.51 |
| logSw: | -2.6743 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.671 |
| InChI Key: | IMADKYPTZSOTBE-UHFFFAOYSA-N |