6-[4-(4-tert-butylbenzoyl)-1,4-diazepan-1-yl]-2-(3,4-dimethylphenyl)pyridazin-3(2H)-one
Chemical Structure Depiction of
6-[4-(4-tert-butylbenzoyl)-1,4-diazepan-1-yl]-2-(3,4-dimethylphenyl)pyridazin-3(2H)-one
6-[4-(4-tert-butylbenzoyl)-1,4-diazepan-1-yl]-2-(3,4-dimethylphenyl)pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | F977-0899 |
| Compound Name: | 6-[4-(4-tert-butylbenzoyl)-1,4-diazepan-1-yl]-2-(3,4-dimethylphenyl)pyridazin-3(2H)-one |
| Molecular Weight: | 458.6 |
| Molecular Formula: | C28 H34 N4 O2 |
| Smiles: | Cc1ccc(cc1C)N1C(C=CC(=N1)N1CCCN(CC1)C(c1ccc(cc1)C(C)(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4754 |
| logD: | 5.4754 |
| logSw: | -5.3554 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.492 |
| InChI Key: | AVIQAZKIUGAGTK-UHFFFAOYSA-N |