2-{5-[(2,5-dimethylphenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}-N-[(4-methylphenyl)methyl]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-[(4-methylphenyl)methyl]acetamide
2-{5-[(2,5-dimethylphenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}-N-[(4-methylphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | C880-1441 |
| Compound Name: | 2-{5-[(2,5-dimethylphenyl)methyl]-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl}-N-[(4-methylphenyl)methyl]acetamide |
| Molecular Weight: | 464.57 |
| Molecular Formula: | C29 H28 N4 O2 |
| Smiles: | Cc1ccc(CNC(CN2C(c3c(C=N2)c2ccccc2n3Cc2cc(C)ccc2C)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.4567 |
| logD: | 5.4567 |
| logSw: | -5.6409 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.543 |
| InChI Key: | QXIUFBPZGZLMOZ-UHFFFAOYSA-N |