ethyl 4-{2-[4-(3-methylpiperidin-1-yl)-1-oxophthalazin-2(1H)-yl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 4-{2-[4-(3-methylpiperidin-1-yl)-1-oxophthalazin-2(1H)-yl]acetamido}benzoate
ethyl 4-{2-[4-(3-methylpiperidin-1-yl)-1-oxophthalazin-2(1H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | M183-1312 |
| Compound Name: | ethyl 4-{2-[4-(3-methylpiperidin-1-yl)-1-oxophthalazin-2(1H)-yl]acetamido}benzoate |
| Molecular Weight: | 448.52 |
| Molecular Formula: | C25 H28 N4 O4 |
| Smiles: | CCOC(c1ccc(cc1)NC(CN1C(c2ccccc2C(=N1)N1CCCC(C)C1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9918 |
| logD: | 3.9917 |
| logSw: | -3.9723 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.074 |
| InChI Key: | LQDOLYCQOFCHHJ-KRWDZBQOSA-N |