2-[3-(3-chloro-4-fluorophenyl)-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl]-N-(4-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-[3-(3-chloro-4-fluorophenyl)-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl]-N-(4-methoxyphenyl)acetamide
2-[3-(3-chloro-4-fluorophenyl)-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl]-N-(4-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | C200-4178 |
| Compound Name: | 2-[3-(3-chloro-4-fluorophenyl)-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl]-N-(4-methoxyphenyl)acetamide |
| Molecular Weight: | 509.94 |
| Molecular Formula: | C25 H17 Cl F N3 O4 S |
| Smiles: | COc1ccc(cc1)NC(CN1C(N(C(c2c1c1ccccc1s2)=O)c1ccc(c(c1)[Cl])F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0795 |
| logD: | 5.0795 |
| logSw: | -5.4788 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.252 |
| InChI Key: | ZGRQJELNNRHQLY-UHFFFAOYSA-N |