ethyl 4-amino-2-({1-[4-(methoxycarbonyl)anilino]-1-oxobutan-2-yl}sulfanyl)pyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-amino-2-({1-[4-(methoxycarbonyl)anilino]-1-oxobutan-2-yl}sulfanyl)pyrimidine-5-carboxylate
ethyl 4-amino-2-({1-[4-(methoxycarbonyl)anilino]-1-oxobutan-2-yl}sulfanyl)pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | E726-0357 |
| Compound Name: | ethyl 4-amino-2-({1-[4-(methoxycarbonyl)anilino]-1-oxobutan-2-yl}sulfanyl)pyrimidine-5-carboxylate |
| Molecular Weight: | 418.47 |
| Molecular Formula: | C19 H22 N4 O5 S |
| Smiles: | CCC(C(Nc1ccc(cc1)C(=O)OC)=O)Sc1ncc(C(=O)OCC)c(N)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3096 |
| logD: | 3.3093 |
| logSw: | -3.6675 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 103.769 |
| InChI Key: | LQMLPFFNUVDBEC-AWEZNQCLSA-N |