2-methoxy-5-{[(2-methoxyethyl)(2,4,6-trimethylbenzene-1-sulfonyl)amino]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
2-methoxy-5-{[(2-methoxyethyl)(2,4,6-trimethylbenzene-1-sulfonyl)amino]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
2-methoxy-5-{[(2-methoxyethyl)(2,4,6-trimethylbenzene-1-sulfonyl)amino]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V014-8805 |
| Compound Name: | 2-methoxy-5-{[(2-methoxyethyl)(2,4,6-trimethylbenzene-1-sulfonyl)amino]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 601.66 |
| Molecular Formula: | C27 H30 F3 N O7 S2 |
| Smiles: | Cc1cc(C)c(c(C)c1)S(N(CCOC)Cc1ccc(c(c1)OS(c1cccc(c1)C(F)(F)F)(=O)=O)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6496 |
| logD: | 5.6496 |
| logSw: | -5.6437 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 83.413 |
| InChI Key: | LQNMSMOJCVQRJK-UHFFFAOYSA-N |