4-{1-[2-(4-ethoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-(4-methoxyphenyl)butanamide
Chemical Structure Depiction of
4-{1-[2-(4-ethoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-(4-methoxyphenyl)butanamide
4-{1-[2-(4-ethoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-(4-methoxyphenyl)butanamide
Compound characteristics
| Compound ID: | C241-1178 |
| Compound Name: | 4-{1-[2-(4-ethoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}-N-(4-methoxyphenyl)butanamide |
| Molecular Weight: | 536.61 |
| Molecular Formula: | C27 H28 N4 O6 S |
| Smiles: | CCOc1ccc(cc1)NC(CN1C(N(CCCC(Nc2ccc(cc2)OC)=O)C(c2c1ccs2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6141 |
| logD: | 3.6141 |
| logSw: | -3.8235 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.23 |
| InChI Key: | RIOUFBHDYWLPLW-UHFFFAOYSA-N |