2-(3-methyl-4-oxo-3,4-dihydro-5H-pyridazino[4,5-b]indol-5-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide
Chemical Structure Depiction of
2-(3-methyl-4-oxo-3,4-dihydro-5H-pyridazino[4,5-b]indol-5-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide
2-(3-methyl-4-oxo-3,4-dihydro-5H-pyridazino[4,5-b]indol-5-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide
Compound characteristics
| Compound ID: | F249-0833 |
| Compound Name: | 2-(3-methyl-4-oxo-3,4-dihydro-5H-pyridazino[4,5-b]indol-5-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide |
| Molecular Weight: | 406.51 |
| Molecular Formula: | C22 H22 N4 O2 S |
| Smiles: | CC(C(NCc1ccc(cc1)SC)=O)n1c2C(N(C)N=Cc2c2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6332 |
| logD: | 2.6331 |
| logSw: | -2.8886 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.403 |
| InChI Key: | MNSGFDQYHKPGFR-AWEZNQCLSA-N |