4-[3-(difluoromethoxy)phenyl]pyrimidine-2-thiol
Chemical Structure Depiction of
4-[3-(difluoromethoxy)phenyl]pyrimidine-2-thiol
4-[3-(difluoromethoxy)phenyl]pyrimidine-2-thiol
Compound characteristics
| Compound ID: | Y502-0173 |
| Compound Name: | 4-[3-(difluoromethoxy)phenyl]pyrimidine-2-thiol |
| Molecular Weight: | 254.26 |
| Molecular Formula: | C11 H8 F2 N2 O S |
| Smiles: | c1cc(cc(c1)OC(F)F)c1ccnc(n1)S |
| Stereo: | ACHIRAL |
| logP: | 2.7323 |
| logD: | 2.2663 |
| logSw: | -2.9929 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 23.1737 |
| InChI Key: | MWHSLYJTDDARRI-UHFFFAOYSA-N |