N-benzyl-2-[3-(3,4-dichlorophenyl)-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-(3,4-dichlorophenyl)-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-(3,4-dichlorophenyl)-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: | C258-0715 |
| Compound Name: | N-benzyl-2-[3-(3,4-dichlorophenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]-N-ethylacetamide |
| Molecular Weight: | 542.48 |
| Molecular Formula: | C27 H25 Cl2 N3 O3 S |
| Smiles: | CCN(Cc1ccccc1)C(CN1C(N(C(c2c3CCCCc3sc12)=O)c1ccc(c(c1)[Cl])[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7007 |
| logD: | 5.7007 |
| logSw: | -6.0967 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.708 |
| InChI Key: | UENUWXZEGAVRHQ-UHFFFAOYSA-N |