2-(3-methyl-4-oxo-3,4-dihydro-5H-pyridazino[4,5-b]indol-5-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide
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}acetamide
2-(3-methyl-4-oxo-3,4-dihydro-5H-pyridazino[4,5-b]indol-5-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide
Compound characteristics
| Compound ID: | F249-0402 |
| Compound Name: | 2-(3-methyl-4-oxo-3,4-dihydro-5H-pyridazino[4,5-b]indol-5-yl)-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide |
| Molecular Weight: | 392.48 |
| Molecular Formula: | C21 H20 N4 O2 S |
| Smiles: | [H]C(C(NCc1ccc(cc1)SC)=O)n1c2C(N(C)N=Cc2c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9946 |
| logD: | 2.9944 |
| logSw: | -3.2118 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.494 |
| InChI Key: | VVKUFNWGCUUUIN-UHFFFAOYSA-N |