N-(3-bromo-4-methylphenyl)-3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxalin-2-amine
Chemical Structure Depiction of
N-(3-bromo-4-methylphenyl)-3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxalin-2-amine
N-(3-bromo-4-methylphenyl)-3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxalin-2-amine
Compound characteristics
| Compound ID: | C301-2316 |
| Compound Name: | N-(3-bromo-4-methylphenyl)-3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxalin-2-amine |
| Molecular Weight: | 408.3 |
| Molecular Formula: | C20 H18 Br N5 |
| Smiles: | Cc1ccc(cc1[Br])Nc1c(nc2ccccc2n1)n1c(C)cc(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.2762 |
| logD: | 5.2753 |
| logSw: | -5.3562 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.528 |
| InChI Key: | YLIMZMMPNVYCBG-UHFFFAOYSA-N |