6-[3-(azepane-1-sulfonyl)-4-methylphenyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)pyridazin-3(2H)-one
Chemical Structure Depiction of
6-[3-(azepane-1-sulfonyl)-4-methylphenyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)pyridazin-3(2H)-one
6-[3-(azepane-1-sulfonyl)-4-methylphenyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | F946-0061 |
| Compound Name: | 6-[3-(azepane-1-sulfonyl)-4-methylphenyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)pyridazin-3(2H)-one |
| Molecular Weight: | 442.54 |
| Molecular Formula: | C22 H26 N4 O4 S |
| Smiles: | Cc1ccc(cc1S(N1CCCCCC1)(=O)=O)C1C=CC(N(c2c(C)noc2C)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4872 |
| logD: | 3.4872 |
| logSw: | -3.8392 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.607 |
| InChI Key: | AGLALQQBIAFSIU-UHFFFAOYSA-N |