methyl 4-{2-[4-(dimethylamino)-1-oxophthalazin-2(1H)-yl]acetamido}benzoate
Chemical Structure Depiction of
methyl 4-{2-[4-(dimethylamino)-1-oxophthalazin-2(1H)-yl]acetamido}benzoate
methyl 4-{2-[4-(dimethylamino)-1-oxophthalazin-2(1H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | M183-0014 |
| Compound Name: | methyl 4-{2-[4-(dimethylamino)-1-oxophthalazin-2(1H)-yl]acetamido}benzoate |
| Molecular Weight: | 380.4 |
| Molecular Formula: | C20 H20 N4 O4 |
| Smiles: | CN(C)C1c2ccccc2C(N(CC(Nc2ccc(cc2)C(=O)OC)=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1168 |
| logD: | 2.1167 |
| logSw: | -3.0111 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.912 |
| InChI Key: | LGIGOPROYCNRPJ-UHFFFAOYSA-N |