methyl (4-{2-[4-(4-chlorophenyl)-1-oxophthalazin-2(1H)-yl]acetamido}phenoxy)acetate
Chemical Structure Depiction of
methyl (4-{2-[4-(4-chlorophenyl)-1-oxophthalazin-2(1H)-yl]acetamido}phenoxy)acetate
methyl (4-{2-[4-(4-chlorophenyl)-1-oxophthalazin-2(1H)-yl]acetamido}phenoxy)acetate
Compound characteristics
| Compound ID: | 8012-7562 |
| Compound Name: | methyl (4-{2-[4-(4-chlorophenyl)-1-oxophthalazin-2(1H)-yl]acetamido}phenoxy)acetate |
| Molecular Weight: | 477.9 |
| Molecular Formula: | C25 H20 Cl N3 O5 |
| Smiles: | COC(COc1ccc(cc1)NC(CN1C(c2ccccc2C(c2ccc(cc2)[Cl])=N1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3982 |
| logD: | 3.3982 |
| logSw: | -4.0883 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.423 |
| InChI Key: | JWYFKUYOGFUNMS-UHFFFAOYSA-N |