4-({N-[(furan-2-yl)methyl]-3,3-dimethylbutanamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
4-({N-[(furan-2-yl)methyl]-3,3-dimethylbutanamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
4-({N-[(furan-2-yl)methyl]-3,3-dimethylbutanamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V006-2293 |
| Compound Name: | 4-({N-[(furan-2-yl)methyl]-3,3-dimethylbutanamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 509.54 |
| Molecular Formula: | C25 H26 F3 N O5 S |
| Smiles: | CC(C)(C)CC(N(Cc1ccc(cc1)OS(c1cccc(c1)C(F)(F)F)(=O)=O)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7187 |
| logD: | 5.7187 |
| logSw: | -5.6083 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.432 |
| InChI Key: | GDTWRFXFAVQGSW-UHFFFAOYSA-N |