3-({tert-butyl-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
3-({tert-butyl-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
3-({tert-butyl-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V027-2559 |
| Compound Name: | 3-({tert-butyl-N-[(furan-2-yl)methyl]carbamamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 510.53 |
| Molecular Formula: | C24 H25 F3 N2 O5 S |
| Smiles: | CC(C)(C)NC(N(Cc1cccc(c1)OS(c1cccc(c1)C(F)(F)F)(=O)=O)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3169 |
| logD: | 5.3169 |
| logSw: | -5.5075 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.926 |
| InChI Key: | HCWRGLCYFRBSQT-UHFFFAOYSA-N |