methyl (4-{2-[4-(4-methylphenyl)-1-oxophthalazin-2(1H)-yl]acetamido}phenoxy)acetate
Chemical Structure Depiction of
methyl (4-{2-[4-(4-methylphenyl)-1-oxophthalazin-2(1H)-yl]acetamido}phenoxy)acetate
methyl (4-{2-[4-(4-methylphenyl)-1-oxophthalazin-2(1H)-yl]acetamido}phenoxy)acetate
Compound characteristics
| Compound ID: | 8012-7609 |
| Compound Name: | methyl (4-{2-[4-(4-methylphenyl)-1-oxophthalazin-2(1H)-yl]acetamido}phenoxy)acetate |
| Molecular Weight: | 457.49 |
| Molecular Formula: | C26 H23 N3 O5 |
| Smiles: | Cc1ccc(cc1)C1c2ccccc2C(N(CC(Nc2ccc(cc2)OCC(=O)OC)=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2269 |
| logD: | 3.2269 |
| logSw: | -3.5934 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.423 |
| InChI Key: | IUBNQOKOAOZDSM-UHFFFAOYSA-N |