2-{1-[2-(4-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-[(4-methylphenyl)methyl]acetamide
Chemical Structure Depiction of
2-{1-[2-(4-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-[(4-methylphenyl)methyl]acetamide
2-{1-[2-(4-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-[(4-methylphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | C241-1694 |
| Compound Name: | 2-{1-[2-(4-methoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-[(4-methylphenyl)methyl]acetamide |
| Molecular Weight: | 492.55 |
| Molecular Formula: | C25 H24 N4 O5 S |
| Smiles: | Cc1ccc(CNC(CN2C(c3c(ccs3)N(CC(Nc3ccc(cc3)OC)=O)C2=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4079 |
| logD: | 3.4079 |
| logSw: | -3.794 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.45 |
| InChI Key: | QMLFKTIHFXZFSV-UHFFFAOYSA-N |