5-{[2-ethyl-N-(2-methoxyethyl)hexanamido]methyl}-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
5-{[2-ethyl-N-(2-methoxyethyl)hexanamido]methyl}-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate
5-{[2-ethyl-N-(2-methoxyethyl)hexanamido]methyl}-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V002-1353 |
| Compound Name: | 5-{[2-ethyl-N-(2-methoxyethyl)hexanamido]methyl}-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 545.62 |
| Molecular Formula: | C26 H34 F3 N O6 S |
| Smiles: | CCCCC(CC)C(N(CCOC)Cc1ccc(c(c1)OS(c1cccc(c1)C(F)(F)F)(=O)=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4771 |
| logD: | 5.4771 |
| logSw: | -5.4159 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.52 |
| InChI Key: | TWCQDTHWWGGXQL-FQEVSTJZSA-N |