N-{3-[butyl(methyl)amino]propyl}-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-{3-[butyl(methyl)amino]propyl}-2-{5-[(2,5-dimethylphenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}acetamide
N-{3-[butyl(methyl)amino]propyl}-2-{5-[(2,5-dimethylphenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}acetamide
Compound characteristics
| Compound ID: | C880-1516 |
| Compound Name: | N-{3-[butyl(methyl)amino]propyl}-2-{5-[(2,5-dimethylphenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}acetamide |
| Molecular Weight: | 487.65 |
| Molecular Formula: | C29 H37 N5 O2 |
| Smiles: | CCCCN(C)CCCNC(CN1C(c2c(C=N1)c1ccccc1n2Cc1cc(C)ccc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5688 |
| logD: | 1.9718 |
| logSw: | -4.1027 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.729 |
| InChI Key: | XXRXUZKLWRXWEP-UHFFFAOYSA-N |