ethyl 4-amino-2-{[1-(3,4-dimethoxyanilino)-1-oxopropan-2-yl]sulfanyl}pyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-amino-2-{[1-(3,4-dimethoxyanilino)-1-oxopropan-2-yl]sulfanyl}pyrimidine-5-carboxylate
ethyl 4-amino-2-{[1-(3,4-dimethoxyanilino)-1-oxopropan-2-yl]sulfanyl}pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | E726-0398 |
| Compound Name: | ethyl 4-amino-2-{[1-(3,4-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(Nc1ccc(c(c1)OC)OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2367 |
| logD: | 2.2366 |
| logSw: | -3.0304 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 97.856 |
| InChI Key: | QUHQPMOAACFFHA-JTQLQIEISA-N |