5-amino-1-(3,4-dimethylphenyl)-1H-pyrazole-4-carbonitrile
Chemical Structure Depiction of
5-amino-1-(3,4-dimethylphenyl)-1H-pyrazole-4-carbonitrile
5-amino-1-(3,4-dimethylphenyl)-1H-pyrazole-4-carbonitrile
Compound characteristics
| Compound ID: | Y021-1196 |
| Compound Name: | 5-amino-1-(3,4-dimethylphenyl)-1H-pyrazole-4-carbonitrile |
| Molecular Weight: | 212.25 |
| Molecular Formula: | C12 H12 N4 |
| Smiles: | Cc1ccc(cc1C)n1c(c(C#N)cn1)N |
| Stereo: | ACHIRAL |
| logP: | 2.653 |
| logD: | 2.653 |
| logSw: | -2.8815 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.611 |
| InChI Key: | BVUVHYIUSUFXGH-UHFFFAOYSA-N |