2-(3,4-dimethylphenyl)-6-{4-[(2-methylphenyl)acetyl]-1,4-diazepan-1-yl}pyridazin-3(2H)-one
Chemical Structure Depiction of
2-(3,4-dimethylphenyl)-6-{4-[(2-methylphenyl)acetyl]-1,4-diazepan-1-yl}pyridazin-3(2H)-one
2-(3,4-dimethylphenyl)-6-{4-[(2-methylphenyl)acetyl]-1,4-diazepan-1-yl}pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | F977-0917 |
| Compound Name: | 2-(3,4-dimethylphenyl)-6-{4-[(2-methylphenyl)acetyl]-1,4-diazepan-1-yl}pyridazin-3(2H)-one |
| Molecular Weight: | 430.55 |
| Molecular Formula: | C26 H30 N4 O2 |
| Smiles: | Cc1ccc(cc1C)N1C(C=CC(=N1)N1CCCN(CC1)C(Cc1ccccc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7171 |
| logD: | 4.7169 |
| logSw: | -4.5431 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 46.965 |
| InChI Key: | JUIRTOSEEFETMY-UHFFFAOYSA-N |