N-[2-chloro-5-(trifluoromethyl)phenyl]-2-{3-[(4-methoxyphenyl)methyl]-2,4-dioxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-1(2H)-yl}acetamide
Chemical Structure Depiction of
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-{3-[(4-methoxyphenyl)methyl]-2,4-dioxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-1(2H)-yl}acetamide
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-{3-[(4-methoxyphenyl)methyl]-2,4-dioxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-1(2H)-yl}acetamide
Compound characteristics
| Compound ID: | E545-0708 |
| Compound Name: | N-[2-chloro-5-(trifluoromethyl)phenyl]-2-{3-[(4-methoxyphenyl)methyl]-2,4-dioxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-1(2H)-yl}acetamide |
| Molecular Weight: | 557.91 |
| Molecular Formula: | C27 H19 Cl F3 N3 O5 |
| Smiles: | COc1ccc(CN2C(c3c(c4ccccc4o3)N(CC(Nc3cc(ccc3[Cl])C(F)(F)F)=O)C2=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.1125 |
| logD: | 6.0831 |
| logSw: | -6.2894 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.567 |
| InChI Key: | KPBJSXACMOCJBX-UHFFFAOYSA-N |