N'-{[3-({[3-cyano-4-methyl-6-(trifluoromethyl)pyridin-2-yl]sulfanyl}methyl)-4-methoxyphenyl]methylidene}-2-(3,4-dimethoxyphenyl)quinoline-4-carbohydrazide
Chemical Structure Depiction of
N'-{[3-({[3-cyano-4-methyl-6-(trifluoromethyl)pyridin-2-yl]sulfanyl}methyl)-4-methoxyphenyl]methylidene}-2-(3,4-dimethoxyphenyl)quinoline-4-carbohydrazide
N'-{[3-({[3-cyano-4-methyl-6-(trifluoromethyl)pyridin-2-yl]sulfanyl}methyl)-4-methoxyphenyl]methylidene}-2-(3,4-dimethoxyphenyl)quinoline-4-carbohydrazide
Compound characteristics
| Compound ID: | Y500-6528 |
| Compound Name: | N'-{[3-({[3-cyano-4-methyl-6-(trifluoromethyl)pyridin-2-yl]sulfanyl}methyl)-4-methoxyphenyl]methylidene}-2-(3,4-dimethoxyphenyl)quinoline-4-carbohydrazide |
| Molecular Weight: | 671.7 |
| Molecular Formula: | C35 H28 F3 N5 O4 S |
| Smiles: | Cc1cc(C(F)(F)F)nc(c1C#N)SCc1cc(/C=N/NC(c2cc(c3ccc(c(c3)OC)OC)nc3ccccc23)=O)ccc1OC |
| Stereo: | ACHIRAL |
| logP: | 7.573 |
| logD: | 7.5728 |
| logSw: | -5.8783 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.037 |
| InChI Key: | MCUZMLOKJNEBTQ-UHFFFAOYSA-N |