ethyl 6-methyl-5-{2-[3-(methylsulfanyl)anilino]-2-oxoethyl}-4-oxo-4,5-dihydro[1,2]oxazolo[5,4-d]pyrimidine-3-carboxylate
Chemical Structure Depiction of
ethyl 6-methyl-5-{2-[3-(methylsulfanyl)anilino]-2-oxoethyl}-4-oxo-4,5-dihydro[1,2]oxazolo[5,4-d]pyrimidine-3-carboxylate
ethyl 6-methyl-5-{2-[3-(methylsulfanyl)anilino]-2-oxoethyl}-4-oxo-4,5-dihydro[1,2]oxazolo[5,4-d]pyrimidine-3-carboxylate
Compound characteristics
| Compound ID: | G662-0604 |
| Compound Name: | ethyl 6-methyl-5-{2-[3-(methylsulfanyl)anilino]-2-oxoethyl}-4-oxo-4,5-dihydro[1,2]oxazolo[5,4-d]pyrimidine-3-carboxylate |
| Molecular Weight: | 402.43 |
| Molecular Formula: | C18 H18 N4 O5 S |
| Smiles: | CCOC(c1c2C(N(CC(Nc3cccc(c3)SC)=O)C(C)=Nc2on1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8726 |
| logD: | 1.8726 |
| logSw: | -2.7708 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.923 |
| InChI Key: | JPONDNGLPBHJNJ-UHFFFAOYSA-N |