ethyl 4-amino-2-{[2-oxo-2-(2,3,5,6-tetrafluoroanilino)ethyl]sulfanyl}pyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-amino-2-{[2-oxo-2-(2,3,5,6-tetrafluoroanilino)ethyl]sulfanyl}pyrimidine-5-carboxylate
ethyl 4-amino-2-{[2-oxo-2-(2,3,5,6-tetrafluoroanilino)ethyl]sulfanyl}pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | E726-0082 |
| Compound Name: | ethyl 4-amino-2-{[2-oxo-2-(2,3,5,6-tetrafluoroanilino)ethyl]sulfanyl}pyrimidine-5-carboxylate |
| Molecular Weight: | 404.34 |
| Molecular Formula: | C15 H12 F4 N4 O3 S |
| Smiles: | CCOC(c1cnc(nc1N)SCC(Nc1c(c(cc(c1F)F)F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4649 |
| logD: | 0.358 |
| logSw: | -2.9337 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.986 |
| InChI Key: | VOMKFJUWYDNXGK-UHFFFAOYSA-N |