N-(2H-1,3-benzodioxol-5-yl)-3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxalin-2-amine
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxalin-2-amine
N-(2H-1,3-benzodioxol-5-yl)-3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxalin-2-amine
Compound characteristics
| Compound ID: | 8017-0123 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxalin-2-amine |
| Molecular Weight: | 359.39 |
| Molecular Formula: | C20 H17 N5 O2 |
| Smiles: | Cc1cc(C)n(c2c(Nc3ccc4c(c3)OCO4)nc3ccccc3n2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.0173 |
| logD: | 4.0165 |
| logSw: | -4.1208 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.644 |
| InChI Key: | JSAIRHVHSYQFOW-UHFFFAOYSA-N |