N-(2H-1,3-benzodioxol-5-yl)-2-{[5-(4-methylphenyl)-4-oxo-3-phenyl-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-{[5-(4-methylphenyl)-4-oxo-3-phenyl-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-{[5-(4-methylphenyl)-4-oxo-3-phenyl-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 3993-1994 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-{[5-(4-methylphenyl)-4-oxo-3-phenyl-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 527.62 |
| Molecular Formula: | C28 H21 N3 O4 S2 |
| Smiles: | Cc1ccc(cc1)c1csc2c1C(N(C(=N2)SCC(Nc1ccc2c(c1)OCO2)=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6844 |
| logD: | 5.6844 |
| logSw: | -5.5172 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.055 |
| InChI Key: | OPDKXIXYAXCAEA-UHFFFAOYSA-N |