4-[1-(3,4-dimethylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]-N-(2-ethylphenyl)-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
4-[1-(3,4-dimethylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]-N-(2-ethylphenyl)-1,4-diazepane-1-carboxamide
4-[1-(3,4-dimethylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]-N-(2-ethylphenyl)-1,4-diazepane-1-carboxamide
Compound characteristics
Compound ID: | F975-0291 |
Compound Name: | 4-[1-(3,4-dimethylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]-N-(2-ethylphenyl)-1,4-diazepane-1-carboxamide |
Molecular Weight: | 445.56 |
Molecular Formula: | C26 H31 N5 O2 |
Smiles: | CCc1ccccc1NC(N1CCCN(CC1)C1C=CC(N(c2ccc(C)c(C)c2)N=1)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.9369 |
logD: | 4.9353 |
logSw: | -4.5138 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.615 |
InChI Key: | QZWMOGITYVXDQJ-UHFFFAOYSA-N |