4-{4-[1-(difluoromethyl)-5-methyl-1H-pyrazole-4-sulfonyl]piperazin-1-yl}-6-(3-methylphenyl)pyrimidine
Chemical Structure Depiction of
4-{4-[1-(difluoromethyl)-5-methyl-1H-pyrazole-4-sulfonyl]piperazin-1-yl}-6-(3-methylphenyl)pyrimidine
4-{4-[1-(difluoromethyl)-5-methyl-1H-pyrazole-4-sulfonyl]piperazin-1-yl}-6-(3-methylphenyl)pyrimidine
Compound characteristics
| Compound ID: | F727-0063 |
| Compound Name: | 4-{4-[1-(difluoromethyl)-5-methyl-1H-pyrazole-4-sulfonyl]piperazin-1-yl}-6-(3-methylphenyl)pyrimidine |
| Molecular Weight: | 448.49 |
| Molecular Formula: | C20 H22 F2 N6 O2 S |
| Smiles: | Cc1cccc(c1)c1cc(ncn1)N1CCN(CC1)S(c1cnn(C(F)F)c1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0478 |
| logD: | 3.0415 |
| logSw: | -3.0893 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.798 |
| InChI Key: | ZCSYBSHLXBFLDQ-UHFFFAOYSA-N |