2-(methylsulfanyl)-4-phenyl-6-[3-(trifluoromethyl)anilino]pyrimidine-5-carbonitrile
Chemical Structure Depiction of
2-(methylsulfanyl)-4-phenyl-6-[3-(trifluoromethyl)anilino]pyrimidine-5-carbonitrile
2-(methylsulfanyl)-4-phenyl-6-[3-(trifluoromethyl)anilino]pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D624-0002 |
| Compound Name: | 2-(methylsulfanyl)-4-phenyl-6-[3-(trifluoromethyl)anilino]pyrimidine-5-carbonitrile |
| Molecular Weight: | 386.4 |
| Molecular Formula: | C19 H13 F3 N4 S |
| Smiles: | CSc1nc(c2ccccc2)c(C#N)c(Nc2cccc(c2)C(F)(F)F)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.6711 |
| logD: | 5.6711 |
| logSw: | -5.9034 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.639 |
| InChI Key: | OVVMMZFTDMMEQK-UHFFFAOYSA-N |