methyl 7-amino-1-[(3-chlorophenyl)methyl]-2-oxo-5-phenyl-1,2-dihydroimidazo[1,5-b]pyridazine-4-carboxylate
Chemical Structure Depiction of
methyl 7-amino-1-[(3-chlorophenyl)methyl]-2-oxo-5-phenyl-1,2-dihydroimidazo[1,5-b]pyridazine-4-carboxylate
methyl 7-amino-1-[(3-chlorophenyl)methyl]-2-oxo-5-phenyl-1,2-dihydroimidazo[1,5-b]pyridazine-4-carboxylate
Compound characteristics
| Compound ID: | Y021-1298 |
| Compound Name: | methyl 7-amino-1-[(3-chlorophenyl)methyl]-2-oxo-5-phenyl-1,2-dihydroimidazo[1,5-b]pyridazine-4-carboxylate |
| Molecular Weight: | 408.84 |
| Molecular Formula: | C21 H17 Cl N4 O3 |
| Smiles: | COC(C1=CC(N(Cc2cccc(c2)[Cl])n2c1c(c1ccccc1)nc2N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1365 |
| logD: | 3.1365 |
| logSw: | -3.4445 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.702 |
| InChI Key: | IXQNKVXCSUNETM-UHFFFAOYSA-N |