6-[4-(3,4-diethoxybenzoyl)-1,4-diazepan-1-yl]-2-(3,4-dimethylphenyl)pyridazin-3(2H)-one
Chemical Structure Depiction of
6-[4-(3,4-diethoxybenzoyl)-1,4-diazepan-1-yl]-2-(3,4-dimethylphenyl)pyridazin-3(2H)-one
6-[4-(3,4-diethoxybenzoyl)-1,4-diazepan-1-yl]-2-(3,4-dimethylphenyl)pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | F977-0357 |
| Compound Name: | 6-[4-(3,4-diethoxybenzoyl)-1,4-diazepan-1-yl]-2-(3,4-dimethylphenyl)pyridazin-3(2H)-one |
| Molecular Weight: | 490.6 |
| Molecular Formula: | C28 H34 N4 O4 |
| Smiles: | CCOc1ccc(cc1OCC)C(N1CCCN(CC1)C1C=CC(N(c2ccc(C)c(C)c2)N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7123 |
| logD: | 3.7123 |
| logSw: | -3.9202 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.912 |
| InChI Key: | IHQJVJNSCUMTJL-UHFFFAOYSA-N |