5-{[4-butyl-N-(2-methylpropyl)benzamido]methyl}-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
5-{[4-butyl-N-(2-methylpropyl)benzamido]methyl}-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate
5-{[4-butyl-N-(2-methylpropyl)benzamido]methyl}-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
Compound ID: | V005-4108 |
Compound Name: | 5-{[4-butyl-N-(2-methylpropyl)benzamido]methyl}-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate |
Molecular Weight: | 577.66 |
Molecular Formula: | C30 H34 F3 N O5 S |
Smiles: | CCCCc1ccc(cc1)C(N(CC(C)C)Cc1ccc(c(c1)OS(c1cccc(c1)C(F)(F)F)(=O)=O)OC)=O |
Stereo: | ACHIRAL |
logP: | 7.2477 |
logD: | 7.2477 |
logSw: | -5.7891 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 59.928 |
InChI Key: | ZNXIIHJYMSESNP-UHFFFAOYSA-N |