2-[3-(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-[2-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-[3-(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-[2-(trifluoromethyl)phenyl]acetamide
2-[3-(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-[2-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | C241-1860 |
| Compound Name: | 2-[3-(2-{[(2-chlorophenyl)methyl]amino}-2-oxoethyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-[2-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 550.94 |
| Molecular Formula: | C24 H18 Cl F3 N4 O4 S |
| Smiles: | C(c1ccccc1[Cl])NC(CN1C(c2c(ccs2)N(CC(Nc2ccccc2C(F)(F)F)=O)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2998 |
| logD: | 4.2998 |
| logSw: | -4.5385 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.208 |
| InChI Key: | BFMHNCFEOWFTRV-UHFFFAOYSA-N |