2-[3-(3-chlorophenyl)-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl]-N-[2-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-[3-(3-chlorophenyl)-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl]-N-[2-(trifluoromethyl)phenyl]acetamide
2-[3-(3-chlorophenyl)-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl]-N-[2-(trifluoromethyl)phenyl]acetamide
Compound characteristics
Compound ID: | C200-4011 |
Compound Name: | 2-[3-(3-chlorophenyl)-2,4-dioxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-1(2H)-yl]-N-[2-(trifluoromethyl)phenyl]acetamide |
Molecular Weight: | 529.92 |
Molecular Formula: | C25 H15 Cl F3 N3 O3 S |
Smiles: | C(C(Nc1ccccc1C(F)(F)F)=O)N1C(N(C(c2c1c1ccccc1s2)=O)c1cccc(c1)[Cl])=O |
Stereo: | ACHIRAL |
logP: | 5.6574 |
logD: | 5.6574 |
logSw: | -5.9753 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.011 |
InChI Key: | GMHVUSHKHYECNC-UHFFFAOYSA-N |