6-[4-(3,4-diethoxybenzoyl)-1,4-diazepan-1-yl]-2-(4-methylphenyl)pyridazin-3(2H)-one
Chemical Structure Depiction of
6-[4-(3,4-diethoxybenzoyl)-1,4-diazepan-1-yl]-2-(4-methylphenyl)pyridazin-3(2H)-one
6-[4-(3,4-diethoxybenzoyl)-1,4-diazepan-1-yl]-2-(4-methylphenyl)pyridazin-3(2H)-one
Compound characteristics
Compound ID: | F977-0781 |
Compound Name: | 6-[4-(3,4-diethoxybenzoyl)-1,4-diazepan-1-yl]-2-(4-methylphenyl)pyridazin-3(2H)-one |
Molecular Weight: | 476.58 |
Molecular Formula: | C27 H32 N4 O4 |
Smiles: | CCOc1ccc(cc1OCC)C(N1CCCN(CC1)C1C=CC(N(c2ccc(C)cc2)N=1)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.9984 |
logD: | 2.9984 |
logSw: | -3.1501 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 61.912 |
InChI Key: | ZCRVGWPBBLCTCN-UHFFFAOYSA-N |