4-bromo-N-[4-cyano-1-(4,6-dimethylpyrimidin-2-yl)-1H-pyrazol-5-yl]benzamide
Chemical Structure Depiction of
4-bromo-N-[4-cyano-1-(4,6-dimethylpyrimidin-2-yl)-1H-pyrazol-5-yl]benzamide
4-bromo-N-[4-cyano-1-(4,6-dimethylpyrimidin-2-yl)-1H-pyrazol-5-yl]benzamide
Compound characteristics
| Compound ID: | Y020-7928 |
| Compound Name: | 4-bromo-N-[4-cyano-1-(4,6-dimethylpyrimidin-2-yl)-1H-pyrazol-5-yl]benzamide |
| Molecular Weight: | 397.23 |
| Molecular Formula: | C17 H13 Br N6 O |
| Smiles: | Cc1cc(C)nc(n1)n1c(c(C#N)cn1)NC(c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.0661 |
| logD: | 2.9052 |
| logSw: | -3.3223 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.234 |
| InChI Key: | IGZBNUKPXJEMQY-UHFFFAOYSA-N |