ethyl 4-{[2-(3,4-difluoroanilino)-2-oxoethyl]sulfanyl}-6-methyl-2-oxo-1,2-dihydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-{[2-(3,4-difluoroanilino)-2-oxoethyl]sulfanyl}-6-methyl-2-oxo-1,2-dihydropyrimidine-5-carboxylate
ethyl 4-{[2-(3,4-difluoroanilino)-2-oxoethyl]sulfanyl}-6-methyl-2-oxo-1,2-dihydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | G857-0868 |
| Compound Name: | ethyl 4-{[2-(3,4-difluoroanilino)-2-oxoethyl]sulfanyl}-6-methyl-2-oxo-1,2-dihydropyrimidine-5-carboxylate |
| Molecular Weight: | 383.37 |
| Molecular Formula: | C16 H15 F2 N3 O4 S |
| Smiles: | CCOC(C1=C(C)NC(N=C1SCC(Nc1ccc(c(c1)F)F)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1037 |
| logD: | -1.1649 |
| logSw: | -2.8453 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.975 |
| InChI Key: | KHJSWKCOKFAJPY-UHFFFAOYSA-N |