N-[(3,4-dimethylphenyl)methyl]-7-fluoro-4-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide
Chemical Structure Depiction of
N-[(3,4-dimethylphenyl)methyl]-7-fluoro-4-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide
N-[(3,4-dimethylphenyl)methyl]-7-fluoro-4-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide
Compound characteristics
| Compound ID: | P516-0301 |
| Compound Name: | N-[(3,4-dimethylphenyl)methyl]-7-fluoro-4-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide |
| Molecular Weight: | 365.37 |
| Molecular Formula: | C19 H16 F N5 O2 |
| Smiles: | Cc1ccc(CNC(c2c3C(Nc4cc(ccc4n3nn2)F)=O)=O)cc1C |
| Stereo: | ACHIRAL |
| logP: | 2.8879 |
| logD: | 2.0978 |
| logSw: | -3.2052 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.671 |
| InChI Key: | KWNWHHXHLBJJSE-UHFFFAOYSA-N |