N-(2-methyl-3-nitrophenyl)-2-(8-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamide
Chemical Structure Depiction of
N-(2-methyl-3-nitrophenyl)-2-(8-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamide
N-(2-methyl-3-nitrophenyl)-2-(8-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamide
Compound characteristics
| Compound ID: | E902-0173 |
| Compound Name: | N-(2-methyl-3-nitrophenyl)-2-(8-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamide |
| Molecular Weight: | 391.38 |
| Molecular Formula: | C20 H17 N5 O4 |
| Smiles: | Cc1ccc2c(c1)c1C=NN(CC(Nc3cccc(c3C)[N+]([O-])=O)=O)C(c1[nH]2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6632 |
| logD: | 2.6626 |
| logSw: | -2.9911 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.973 |
| InChI Key: | OUQYXHDBBGMLIY-UHFFFAOYSA-N |