N-benzyl-2-(2,4-dioxo-3-phenyl-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-(2,4-dioxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl)-N-ethylacetamide
N-benzyl-2-(2,4-dioxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl)-N-ethylacetamide
Compound characteristics
| Compound ID: | C258-0646 |
| Compound Name: | N-benzyl-2-(2,4-dioxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl)-N-ethylacetamide |
| Molecular Weight: | 473.59 |
| Molecular Formula: | C27 H27 N3 O3 S |
| Smiles: | CCN(Cc1ccccc1)C(CN1C(N(C(c2c3CCCCc3sc12)=O)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2402 |
| logD: | 4.2402 |
| logSw: | -4.31 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.708 |
| InChI Key: | XPQKWXSJCWJWKI-UHFFFAOYSA-N |