N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{5-[(2,5-dimethylphenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{5-[(2,5-dimethylphenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{5-[(2,5-dimethylphenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}acetamide
Compound characteristics
| Compound ID: | C880-1444 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{5-[(2,5-dimethylphenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}acetamide |
| Molecular Weight: | 494.55 |
| Molecular Formula: | C29 H26 N4 O4 |
| Smiles: | Cc1ccc(C)c(Cn2c3C(N(CC(NCc4ccc5c(c4)OCO5)=O)N=Cc3c3ccccc23)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.9464 |
| logD: | 4.9464 |
| logSw: | -4.8644 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.659 |
| InChI Key: | SEVXUPMAUZGPDF-UHFFFAOYSA-N |