2-{3-[(4-methoxyphenyl)methyl]-2,4-dioxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-1(2H)-yl}-N-[3-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-{3-[(4-methoxyphenyl)methyl]-2,4-dioxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-1(2H)-yl}-N-[3-(trifluoromethyl)phenyl]acetamide
2-{3-[(4-methoxyphenyl)methyl]-2,4-dioxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-1(2H)-yl}-N-[3-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | E545-0714 |
| Compound Name: | 2-{3-[(4-methoxyphenyl)methyl]-2,4-dioxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-1(2H)-yl}-N-[3-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 523.47 |
| Molecular Formula: | C27 H20 F3 N3 O5 |
| Smiles: | COc1ccc(CN2C(c3c(c4ccccc4o3)N(CC(Nc3cccc(c3)C(F)(F)F)=O)C2=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.9308 |
| logD: | 5.9304 |
| logSw: | -5.8982 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.265 |
| InChI Key: | CBXHQTGIYAMKDP-UHFFFAOYSA-N |