N-[(2-chlorophenyl)methyl]-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-chlorophenyl)methyl]-2-{3-[(4-methoxyphenyl)methyl]-2,4-dioxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-1(2H)-yl}acetamide
N-[(2-chlorophenyl)methyl]-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: | E545-0710 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-2-{3-[(4-methoxyphenyl)methyl]-2,4-dioxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-1(2H)-yl}acetamide |
| Molecular Weight: | 503.94 |
| Molecular Formula: | C27 H22 Cl N3 O5 |
| Smiles: | COc1ccc(CN2C(c3c(c4ccccc4o3)N(CC(NCc3ccccc3[Cl])=O)C2=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.2473 |
| logD: | 5.2473 |
| logSw: | -5.7277 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.587 |
| InChI Key: | VJINEXWUSDHMLK-UHFFFAOYSA-N |