N-benzyl-2-[3-(2,4-dimethoxyphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]-N-ethylacetamide
Chemical Structure Depiction of
N-benzyl-2-[3-(2,4-dimethoxyphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]-N-ethylacetamide
N-benzyl-2-[3-(2,4-dimethoxyphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]-N-ethylacetamide
Compound characteristics
| Compound ID: | C258-0386 |
| Compound Name: | N-benzyl-2-[3-(2,4-dimethoxyphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]-N-ethylacetamide |
| Molecular Weight: | 533.65 |
| Molecular Formula: | C29 H31 N3 O5 S |
| Smiles: | CCN(Cc1ccccc1)C(CN1C(N(C(c2c3CCCCc3sc12)=O)c1ccc(cc1OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5648 |
| logD: | 4.5648 |
| logSw: | -4.5868 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.581 |
| InChI Key: | GNUZJFXXUPCJBV-UHFFFAOYSA-N |