2-methoxy-5-{[3-methyl-N-(2-methylpropyl)butanamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
2-methoxy-5-{[3-methyl-N-(2-methylpropyl)butanamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
2-methoxy-5-{[3-methyl-N-(2-methylpropyl)butanamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
Compound ID: | V029-6694 |
Compound Name: | 2-methoxy-5-{[3-methyl-N-(2-methylpropyl)butanamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate |
Molecular Weight: | 501.56 |
Molecular Formula: | C24 H30 F3 N O5 S |
Smiles: | CC(C)CC(N(CC(C)C)Cc1ccc(c(c1)OS(c1cccc(c1)C(F)(F)F)(=O)=O)OC)=O |
Stereo: | ACHIRAL |
logP: | 5.2709 |
logD: | 5.2709 |
logSw: | -5.4042 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 59.672 |
InChI Key: | ARPUWPRSOSSGRI-UHFFFAOYSA-N |