propan-2-yl 4-[2-(6-oxo-3-phenylpyridazin-1(6H)-yl)acetamido]benzoate
Chemical Structure Depiction of
propan-2-yl 4-[2-(6-oxo-3-phenylpyridazin-1(6H)-yl)acetamido]benzoate
propan-2-yl 4-[2-(6-oxo-3-phenylpyridazin-1(6H)-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | Y043-1430 |
| Compound Name: | propan-2-yl 4-[2-(6-oxo-3-phenylpyridazin-1(6H)-yl)acetamido]benzoate |
| Molecular Weight: | 391.43 |
| Molecular Formula: | C22 H21 N3 O4 |
| Smiles: | CC(C)OC(c1ccc(cc1)NC(CN1C(C=CC(c2ccccc2)=N1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6034 |
| logD: | 3.6034 |
| logSw: | -3.666 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.13 |
| InChI Key: | XOOWDLGMCUPXGR-UHFFFAOYSA-N |