methyl 2-{2-[6-oxo-3-(pyrrolidine-1-carbonyl)pyridazin-1(6H)-yl]acetamido}benzoate
Chemical Structure Depiction of
methyl 2-{2-[6-oxo-3-(pyrrolidine-1-carbonyl)pyridazin-1(6H)-yl]acetamido}benzoate
methyl 2-{2-[6-oxo-3-(pyrrolidine-1-carbonyl)pyridazin-1(6H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | L702-0404 |
| Compound Name: | methyl 2-{2-[6-oxo-3-(pyrrolidine-1-carbonyl)pyridazin-1(6H)-yl]acetamido}benzoate |
| Molecular Weight: | 384.39 |
| Molecular Formula: | C19 H20 N4 O5 |
| Smiles: | COC(c1ccccc1NC(CN1C(C=CC(C(N2CCCC2)=O)=N1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1326 |
| logD: | 1.1267 |
| logSw: | -2.4396 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.459 |
| InChI Key: | XZQFSVUIUURJQG-UHFFFAOYSA-N |