2-{4-oxo-5-[(2,4,6-trimethylphenyl)methyl]-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}-N-[(pyridin-3-yl)methyl]acetamide
Chemical Structure Depiction of
2-{4-oxo-5-[(2,4,6-trimethylphenyl)methyl]-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}-N-[(pyridin-3-yl)methyl]acetamide
2-{4-oxo-5-[(2,4,6-trimethylphenyl)methyl]-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}-N-[(pyridin-3-yl)methyl]acetamide
Compound characteristics
| Compound ID: | C880-1556 |
| Compound Name: | 2-{4-oxo-5-[(2,4,6-trimethylphenyl)methyl]-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}-N-[(pyridin-3-yl)methyl]acetamide |
| Molecular Weight: | 465.55 |
| Molecular Formula: | C28 H27 N5 O2 |
| Smiles: | Cc1cc(C)c(Cn2c3C(N(CC(NCc4cccnc4)=O)N=Cc3c3ccccc23)=O)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.177 |
| logD: | 4.1745 |
| logSw: | -4.2025 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.061 |
| InChI Key: | KWLCCBJFVVZJNW-UHFFFAOYSA-N |