ethyl 4-[(2,5-difluorophenyl)carbamamido]-2-(methylsulfanyl)pyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-[(2,5-difluorophenyl)carbamamido]-2-(methylsulfanyl)pyrimidine-5-carboxylate
ethyl 4-[(2,5-difluorophenyl)carbamamido]-2-(methylsulfanyl)pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | E729-0048 |
| Compound Name: | ethyl 4-[(2,5-difluorophenyl)carbamamido]-2-(methylsulfanyl)pyrimidine-5-carboxylate |
| Molecular Weight: | 368.36 |
| Molecular Formula: | C15 H14 F2 N4 O3 S |
| Smiles: | CCOC(c1cnc(nc1NC(Nc1cc(ccc1F)F)=O)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7131 |
| logD: | 0.5655 |
| logSw: | -3.8467 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.052 |
| InChI Key: | AEHBQAQVUOAZBF-UHFFFAOYSA-N |