ethyl 2-{[(3-tert-butoxy-2-hydroxypropyl)(propan-2-yl)amino]methyl}-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 2-{[(3-tert-butoxy-2-hydroxypropyl)(propan-2-yl)amino]methyl}-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
ethyl 2-{[(3-tert-butoxy-2-hydroxypropyl)(propan-2-yl)amino]methyl}-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V022-4281 |
| Compound Name: | ethyl 2-{[(3-tert-butoxy-2-hydroxypropyl)(propan-2-yl)amino]methyl}-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate |
| Molecular Weight: | 439.57 |
| Molecular Formula: | C21 H33 N3 O5 S |
| Salt: | not_available |
| Smiles: | CCOC(c1c(C)c2C(NC(CN(CC(COC(C)(C)C)O)C(C)C)=Nc2s1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9267 |
| logD: | 2.9243 |
| logSw: | -3.0919 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.779 |
| InChI Key: | OQMYONNGURYETO-AWEZNQCLSA-N |