6-{4-[4-(2,5-dimethyl-1H-pyrrol-1-yl)benzoyl]-1,4-diazepan-1-yl}-2-(4-methylphenyl)pyridazin-3(2H)-one
Chemical Structure Depiction of
6-{4-[4-(2,5-dimethyl-1H-pyrrol-1-yl)benzoyl]-1,4-diazepan-1-yl}-2-(4-methylphenyl)pyridazin-3(2H)-one
6-{4-[4-(2,5-dimethyl-1H-pyrrol-1-yl)benzoyl]-1,4-diazepan-1-yl}-2-(4-methylphenyl)pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | F977-0807 |
| Compound Name: | 6-{4-[4-(2,5-dimethyl-1H-pyrrol-1-yl)benzoyl]-1,4-diazepan-1-yl}-2-(4-methylphenyl)pyridazin-3(2H)-one |
| Molecular Weight: | 481.6 |
| Molecular Formula: | C29 H31 N5 O2 |
| Smiles: | Cc1ccc(cc1)N1C(C=CC(=N1)N1CCCN(CC1)C(c1ccc(cc1)n1c(C)ccc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7951 |
| logD: | 3.795 |
| logSw: | -3.907 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.381 |
| InChI Key: | RZCGGDOCNZVCRS-UHFFFAOYSA-N |