4-{[ethyl-N-(2-methoxyethyl)carbamamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
4-{[ethyl-N-(2-methoxyethyl)carbamamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
4-{[ethyl-N-(2-methoxyethyl)carbamamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V027-9178 |
| Compound Name: | 4-{[ethyl-N-(2-methoxyethyl)carbamamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 460.47 |
| Molecular Formula: | C20 H23 F3 N2 O5 S |
| Smiles: | CCNC(N(CCOC)Cc1ccc(cc1)OS(c1cccc(c1)C(F)(F)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2299 |
| logD: | 3.2299 |
| logSw: | -3.6478 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.572 |
| InChI Key: | HWTKEDHYVDTWTR-UHFFFAOYSA-N |