ethyl 4-amino-2-{[2-oxo-2-(2,4,6-trimethylanilino)ethyl]sulfanyl}pyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-amino-2-{[2-oxo-2-(2,4,6-trimethylanilino)ethyl]sulfanyl}pyrimidine-5-carboxylate
ethyl 4-amino-2-{[2-oxo-2-(2,4,6-trimethylanilino)ethyl]sulfanyl}pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | D133-0028 |
| Compound Name: | ethyl 4-amino-2-{[2-oxo-2-(2,4,6-trimethylanilino)ethyl]sulfanyl}pyrimidine-5-carboxylate |
| Molecular Weight: | 374.46 |
| Molecular Formula: | C18 H22 N4 O3 S |
| Smiles: | CCOC(c1cnc(nc1N)SCC(Nc1c(C)cc(C)cc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7829 |
| logD: | 2.7829 |
| logSw: | -3.0749 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.986 |
| InChI Key: | FGROYZUVJYOOCO-UHFFFAOYSA-N |