2-{5-[(2,5-dimethylphenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}-N-[(pyridin-3-yl)methyl]acetamide
Chemical Structure Depiction of
2-{5-[(2,5-dimethylphenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}-N-[(pyridin-3-yl)methyl]acetamide
2-{5-[(2,5-dimethylphenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}-N-[(pyridin-3-yl)methyl]acetamide
Compound characteristics
| Compound ID: | C880-1403 |
| Compound Name: | 2-{5-[(2,5-dimethylphenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}-N-[(pyridin-3-yl)methyl]acetamide |
| Molecular Weight: | 451.53 |
| Molecular Formula: | C27 H25 N5 O2 |
| Smiles: | Cc1ccc(C)c(Cn2c3C(N(CC(NCc4cccnc4)=O)N=Cc3c3ccccc23)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.8056 |
| logD: | 3.8031 |
| logSw: | -3.727 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.061 |
| InChI Key: | YVCNLCSNYBWPRG-UHFFFAOYSA-N |