ethyl 2-(2-{[(4-chlorophenyl)methyl]amino}-2-oxoethyl)-3-oxo-3,5,7,8-tetrahydropyrido[4,3-c]pyridazine-6(2H)-carboxylate
Chemical Structure Depiction of
ethyl 2-(2-{[(4-chlorophenyl)methyl]amino}-2-oxoethyl)-3-oxo-3,5,7,8-tetrahydropyrido[4,3-c]pyridazine-6(2H)-carboxylate
ethyl 2-(2-{[(4-chlorophenyl)methyl]amino}-2-oxoethyl)-3-oxo-3,5,7,8-tetrahydropyrido[4,3-c]pyridazine-6(2H)-carboxylate
Compound characteristics
| Compound ID: | S349-0432 |
| Compound Name: | ethyl 2-(2-{[(4-chlorophenyl)methyl]amino}-2-oxoethyl)-3-oxo-3,5,7,8-tetrahydropyrido[4,3-c]pyridazine-6(2H)-carboxylate |
| Molecular Weight: | 404.85 |
| Molecular Formula: | C19 H21 Cl N4 O4 |
| Smiles: | CCOC(N1CCC2C(C1)=CC(N(CC(NCc1ccc(cc1)[Cl])=O)N=2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7703 |
| logD: | 1.7703 |
| logSw: | -2.9011 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.418 |
| InChI Key: | SZSMNDSXBZMBCB-UHFFFAOYSA-N |