ethyl 4-amino-2-{[1-(2-methoxyanilino)-1-oxobutan-2-yl]sulfanyl}pyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-amino-2-{[1-(2-methoxyanilino)-1-oxobutan-2-yl]sulfanyl}pyrimidine-5-carboxylate
ethyl 4-amino-2-{[1-(2-methoxyanilino)-1-oxobutan-2-yl]sulfanyl}pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | E726-0307 |
| Compound Name: | ethyl 4-amino-2-{[1-(2-methoxyanilino)-1-oxobutan-2-yl]sulfanyl}pyrimidine-5-carboxylate |
| Molecular Weight: | 390.46 |
| Molecular Formula: | C18 H22 N4 O4 S |
| Smiles: | CCC(C(Nc1ccccc1OC)=O)Sc1ncc(C(=O)OCC)c(N)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2705 |
| logD: | 3.2704 |
| logSw: | -3.5018 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.527 |
| InChI Key: | OCQOIXCSGAMFQT-AWEZNQCLSA-N |