methyl 4-[2-(6-acetyl-3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2(3H)-yl)acetamido]benzoate
Chemical Structure Depiction of
methyl 4-[2-(6-acetyl-3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2(3H)-yl)acetamido]benzoate
methyl 4-[2-(6-acetyl-3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2(3H)-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | S349-0106 |
| Compound Name: | methyl 4-[2-(6-acetyl-3-oxo-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-2(3H)-yl)acetamido]benzoate |
| Molecular Weight: | 384.39 |
| Molecular Formula: | C19 H20 N4 O5 |
| Smiles: | CC(N1CCC2C(C1)=CC(N(CC(Nc1ccc(cc1)C(=O)OC)=O)N=2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7597 |
| logD: | 0.7596 |
| logSw: | -1.9441 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.685 |
| InChI Key: | LBXYHCHGSQHJGD-UHFFFAOYSA-N |