N-[(4-methylphenyl)methyl]-3-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)amino]benzamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-3-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)amino]benzamide
N-[(4-methylphenyl)methyl]-3-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)amino]benzamide
Compound characteristics
| Compound ID: | C301-3705 |
| Compound Name: | N-[(4-methylphenyl)methyl]-3-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)amino]benzamide |
| Molecular Weight: | 408.46 |
| Molecular Formula: | C24 H20 N6 O |
| Smiles: | Cc1ccc(CNC(c2cccc(c2)Nc2c3nncn3c3ccccc3n2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9621 |
| logD: | 3.9568 |
| logSw: | -4.0309 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.492 |
| InChI Key: | PTHIVQALFRNNIS-UHFFFAOYSA-N |