ethyl 4-amino-2-{[1-(2,5-dimethoxyanilino)-1-oxopropan-2-yl]sulfanyl}pyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-amino-2-{[1-(2,5-dimethoxyanilino)-1-oxopropan-2-yl]sulfanyl}pyrimidine-5-carboxylate
ethyl 4-amino-2-{[1-(2,5-dimethoxyanilino)-1-oxopropan-2-yl]sulfanyl}pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | E726-0399 |
| Compound Name: | ethyl 4-amino-2-{[1-(2,5-dimethoxyanilino)-1-oxopropan-2-yl]sulfanyl}pyrimidine-5-carboxylate |
| Molecular Weight: | 406.46 |
| Molecular Formula: | C18 H22 N4 O5 S |
| Smiles: | CCOC(c1cnc(nc1N)SC(C)C(Nc1cc(ccc1OC)OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6838 |
| logD: | 2.683 |
| logSw: | -3.2377 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 97.071 |
| InChI Key: | MKZHPSYXEIKNMC-JTQLQIEISA-N |