3-({acetyl[(furan-2-yl)methyl]amino}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
3-({acetyl[(furan-2-yl)methyl]amino}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
3-({acetyl[(furan-2-yl)methyl]amino}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V027-3790 |
| Compound Name: | 3-({acetyl[(furan-2-yl)methyl]amino}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 453.44 |
| Molecular Formula: | C21 H18 F3 N O5 S |
| Smiles: | CC(N(Cc1cccc(c1)OS(c1cccc(c1)C(F)(F)F)(=O)=O)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9656 |
| logD: | 3.9656 |
| logSw: | -4.1547 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.428 |
| InChI Key: | MIHMUVOSNLSMPE-UHFFFAOYSA-N |