ethyl 2-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]-3-oxo-3,5,7,8-tetrahydropyrido[4,3-c]pyridazine-6(2H)-carboxylate
Chemical Structure Depiction of
ethyl 2-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]-3-oxo-3,5,7,8-tetrahydropyrido[4,3-c]pyridazine-6(2H)-carboxylate
ethyl 2-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]-3-oxo-3,5,7,8-tetrahydropyrido[4,3-c]pyridazine-6(2H)-carboxylate
Compound characteristics
| Compound ID: | S349-0415 |
| Compound Name: | ethyl 2-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]-3-oxo-3,5,7,8-tetrahydropyrido[4,3-c]pyridazine-6(2H)-carboxylate |
| Molecular Weight: | 398.46 |
| Molecular Formula: | C21 H26 N4 O4 |
| Smiles: | CCc1cccc(C)c1NC(CN1C(C=C2CN(CCC2=N1)C(=O)OCC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2665 |
| logD: | 2.2665 |
| logSw: | -2.5235 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.7 |
| InChI Key: | PIWAVMNBGPHLPR-UHFFFAOYSA-N |