methyl 3-[2-(4-oxo-5-propyl-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamido]thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-[2-(4-oxo-5-propyl-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamido]thiophene-2-carboxylate
methyl 3-[2-(4-oxo-5-propyl-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamido]thiophene-2-carboxylate
Compound characteristics
| Compound ID: | E717-0242 |
| Compound Name: | methyl 3-[2-(4-oxo-5-propyl-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamido]thiophene-2-carboxylate |
| Molecular Weight: | 424.48 |
| Molecular Formula: | C21 H20 N4 O4 S |
| Smiles: | CCCn1c2C(N(CC(Nc3ccsc3C(=O)OC)=O)N=Cc2c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9836 |
| logD: | 2.9692 |
| logSw: | -3.109 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.965 |
| InChI Key: | PJONUMBZUXSKLJ-UHFFFAOYSA-N |