ethyl 2-{[5-cyano-4-(4-fluorophenyl)pyrimidin-2-yl]amino}-4-methyl-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-{[5-cyano-4-(4-fluorophenyl)pyrimidin-2-yl]amino}-4-methyl-1,3-thiazole-5-carboxylate
ethyl 2-{[5-cyano-4-(4-fluorophenyl)pyrimidin-2-yl]amino}-4-methyl-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | Y020-1368 |
| Compound Name: | ethyl 2-{[5-cyano-4-(4-fluorophenyl)pyrimidin-2-yl]amino}-4-methyl-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 383.4 |
| Molecular Formula: | C18 H14 F N5 O2 S |
| Smiles: | CCOC(c1c(C)nc(Nc2ncc(C#N)c(c3ccc(cc3)F)n2)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9296 |
| logD: | 3.9293 |
| logSw: | -3.9234 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.31 |
| InChI Key: | MZQJTXGFBBZEHR-UHFFFAOYSA-N |