3-(3,5-dimethyl-1H-pyrazol-1-yl)-N-(2-methyl-4-nitrophenyl)quinoxalin-2-amine
Chemical Structure Depiction of
3-(3,5-dimethyl-1H-pyrazol-1-yl)-N-(2-methyl-4-nitrophenyl)quinoxalin-2-amine
3-(3,5-dimethyl-1H-pyrazol-1-yl)-N-(2-methyl-4-nitrophenyl)quinoxalin-2-amine
Compound characteristics
| Compound ID: | C301-1078 |
| Compound Name: | 3-(3,5-dimethyl-1H-pyrazol-1-yl)-N-(2-methyl-4-nitrophenyl)quinoxalin-2-amine |
| Molecular Weight: | 374.4 |
| Molecular Formula: | C20 H18 N6 O2 |
| Smiles: | Cc1cc(ccc1Nc1c(nc2ccccc2n1)n1c(C)cc(C)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.4768 |
| logD: | 4.4745 |
| logSw: | -4.3856 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.212 |
| InChI Key: | PYYQFTJCOPJONZ-UHFFFAOYSA-N |