2-methoxy-5-{[N-(2-methoxyethyl)-3,5,5-trimethylhexanamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
2-methoxy-5-{[N-(2-methoxyethyl)-3,5,5-trimethylhexanamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
2-methoxy-5-{[N-(2-methoxyethyl)-3,5,5-trimethylhexanamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V002-1343 |
| Compound Name: | 2-methoxy-5-{[N-(2-methoxyethyl)-3,5,5-trimethylhexanamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 559.65 |
| Molecular Formula: | C27 H36 F3 N O6 S |
| Smiles: | CC(CC(N(CCOC)Cc1ccc(c(c1)OS(c1cccc(c1)C(F)(F)F)(=O)=O)OC)=O)CC(C)(C)C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4412 |
| logD: | 5.4412 |
| logSw: | -5.5697 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.993 |
| InChI Key: | ACYKTGUGHLHIMR-LJQANCHMSA-N |