2-{5-[(2,5-dimethylphenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}-N-[2-(4-methylpiperazin-1-yl)ethyl]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-[2-(4-methylpiperazin-1-yl)ethyl]acetamide
2-{5-[(2,5-dimethylphenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide
Compound characteristics
| Compound ID: | C880-1517 |
| Compound Name: | 2-{5-[(2,5-dimethylphenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}-N-[2-(4-methylpiperazin-1-yl)ethyl]acetamide |
| Molecular Weight: | 486.62 |
| Molecular Formula: | C28 H34 N6 O2 |
| Smiles: | Cc1ccc(C)c(Cn2c3C(N(CC(NCCN4CCN(C)CC4)=O)N=Cc3c3ccccc23)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.8601 |
| logD: | 2.1926 |
| logSw: | -3.0213 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.844 |
| InChI Key: | PVCAZWRSKXKBGO-UHFFFAOYSA-N |