ethyl 4-amino-2-({2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl}sulfanyl)pyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-amino-2-({2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl}sulfanyl)pyrimidine-5-carboxylate
ethyl 4-amino-2-({2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl}sulfanyl)pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 8017-6865 |
| Compound Name: | ethyl 4-amino-2-({2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl}sulfanyl)pyrimidine-5-carboxylate |
| Molecular Weight: | 416.38 |
| Molecular Formula: | C16 H15 F3 N4 O4 S |
| Smiles: | CCOC(c1cnc(nc1N)SCC(Nc1ccc(cc1)OC(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4609 |
| logD: | 3.4609 |
| logSw: | -3.7939 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 88.318 |
| InChI Key: | SPXLPVHSOIPCCF-UHFFFAOYSA-N |