N-[3-(methylsulfanyl)phenyl]-2-(4-oxo-5-propyl-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamide
Chemical Structure Depiction of
N-[3-(methylsulfanyl)phenyl]-2-(4-oxo-5-propyl-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamide
N-[3-(methylsulfanyl)phenyl]-2-(4-oxo-5-propyl-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamide
Compound characteristics
| Compound ID: | E717-0180 |
| Compound Name: | N-[3-(methylsulfanyl)phenyl]-2-(4-oxo-5-propyl-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamide |
| Molecular Weight: | 406.51 |
| Molecular Formula: | C22 H22 N4 O2 S |
| Smiles: | CCCn1c2C(N(CC(Nc3cccc(c3)SC)=O)N=Cc2c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0261 |
| logD: | 4.0261 |
| logSw: | -3.9566 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.471 |
| InChI Key: | KFJLZVXJFOLPCT-UHFFFAOYSA-N |