2-{4-oxo-5-[(2,4,6-trimethylphenyl)methyl]-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}-N-[3-(pyrrolidin-1-yl)propyl]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-[3-(pyrrolidin-1-yl)propyl]acetamide
2-{4-oxo-5-[(2,4,6-trimethylphenyl)methyl]-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}-N-[3-(pyrrolidin-1-yl)propyl]acetamide
Compound characteristics
| Compound ID: | C880-1646 |
| Compound Name: | 2-{4-oxo-5-[(2,4,6-trimethylphenyl)methyl]-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}-N-[3-(pyrrolidin-1-yl)propyl]acetamide |
| Molecular Weight: | 485.63 |
| Molecular Formula: | C29 H35 N5 O2 |
| Smiles: | Cc1cc(C)c(Cn2c3C(N(CC(NCCCN4CCCC4)=O)N=Cc3c3ccccc23)=O)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.184 |
| logD: | 1.0935 |
| logSw: | -4.1584 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.733 |
| InChI Key: | XRBQOECVHNJGMO-UHFFFAOYSA-N |