2-[3-(4-ethoxyphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]-N-[(4-methylphenyl)methyl]acetamide
Chemical Structure Depiction of
2-[3-(4-ethoxyphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]-N-[(4-methylphenyl)methyl]acetamide
2-[3-(4-ethoxyphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]-N-[(4-methylphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | C200-0823 |
| Compound Name: | 2-[3-(4-ethoxyphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]-N-[(4-methylphenyl)methyl]acetamide |
| Molecular Weight: | 503.62 |
| Molecular Formula: | C28 H29 N3 O4 S |
| Smiles: | CCOc1ccc(cc1)N1C(c2c3CCCCc3sc2N(CC(NCc2ccc(C)cc2)=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8327 |
| logD: | 4.8327 |
| logSw: | -4.5383 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.623 |
| InChI Key: | FQURZJFYKJLNIC-UHFFFAOYSA-N |