2-[3-(5-chloro-2-methylphenyl)-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl]-N-(4-ethoxyphenyl)acetamide
Chemical Structure Depiction of
2-[3-(5-chloro-2-methylphenyl)-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl]-N-(4-ethoxyphenyl)acetamide
2-[3-(5-chloro-2-methylphenyl)-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl]-N-(4-ethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | C200-4010 |
| Compound Name: | 2-[3-(5-chloro-2-methylphenyl)-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl]-N-(4-ethoxyphenyl)acetamide |
| Molecular Weight: | 520.01 |
| Molecular Formula: | C27 H22 Cl N3 O4 S |
| Smiles: | CCOc1ccc(cc1)NC(CN1C(N(C(c2c1c1ccccc1s2)=O)c1cc(ccc1C)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1492 |
| logD: | 6.1492 |
| logSw: | -6.0186 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.531 |
| InChI Key: | SCHYYZHSIGJZKR-UHFFFAOYSA-N |