methyl 2-(2-{[(6-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)methyl]sulfanyl}acetamido)-5-(propan-2-yl)-1,3-thiazole-4-carboxylate
Chemical Structure Depiction of
methyl 2-(2-{[(6-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)methyl]sulfanyl}acetamido)-5-(propan-2-yl)-1,3-thiazole-4-carboxylate
methyl 2-(2-{[(6-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)methyl]sulfanyl}acetamido)-5-(propan-2-yl)-1,3-thiazole-4-carboxylate
Compound characteristics
| Compound ID: | Y043-2627 |
| Compound Name: | methyl 2-(2-{[(6-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)methyl]sulfanyl}acetamido)-5-(propan-2-yl)-1,3-thiazole-4-carboxylate |
| Molecular Weight: | 452.57 |
| Molecular Formula: | C18 H20 N4 O4 S3 |
| Smiles: | CC(C)c1c(C(=O)OC)nc(NC(CSCC2NC(c3cc(C)sc3N=2)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.6458 |
| logD: | 3.6053 |
| logSw: | -3.9084 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.943 |
| InChI Key: | PPKURGCBVNNOLI-UHFFFAOYSA-N |