ethyl 3-amino-2-{[1-(cyclohexylamino)-1-oxobutan-2-yl]sulfanyl}-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 3-amino-2-{[1-(cyclohexylamino)-1-oxobutan-2-yl]sulfanyl}-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
ethyl 3-amino-2-{[1-(cyclohexylamino)-1-oxobutan-2-yl]sulfanyl}-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | K285-5166 |
| Compound Name: | ethyl 3-amino-2-{[1-(cyclohexylamino)-1-oxobutan-2-yl]sulfanyl}-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate |
| Molecular Weight: | 452.59 |
| Molecular Formula: | C20 H28 N4 O4 S2 |
| Smiles: | CCC(C(NC1CCCCC1)=O)SC1=Nc2c(C(N1N)=O)c(C)c(C(=O)OCC)s2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6011 |
| logD: | 3.6011 |
| logSw: | -3.9286 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 87.614 |
| InChI Key: | SXBPFHKPFOCNBF-ZDUSSCGKSA-N |