N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[3-(4-ethoxyphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]acetamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[3-(4-ethoxyphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]acetamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[3-(4-ethoxyphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]acetamide
Compound characteristics
| Compound ID: | C258-0166 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[3-(4-ethoxyphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]acetamide |
| Molecular Weight: | 563.67 |
| Molecular Formula: | C30 H33 N3 O6 S |
| Smiles: | CCOc1ccc(cc1)N1C(c2c3CCCCc3sc2N(CC(NCCc2ccc(c(c2)OC)OC)=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7011 |
| logD: | 3.7011 |
| logSw: | -4.1809 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.725 |
| InChI Key: | AOIQMBSOQDKCDD-UHFFFAOYSA-N |