methyl 2-(benzenesulfonyl)-3-(trifluoromethyl)-2-azabicyclo[2.2.1]hept-5-ene-3-carboxylate
Chemical Structure Depiction of
methyl 2-(benzenesulfonyl)-3-(trifluoromethyl)-2-azabicyclo[2.2.1]hept-5-ene-3-carboxylate
methyl 2-(benzenesulfonyl)-3-(trifluoromethyl)-2-azabicyclo[2.2.1]hept-5-ene-3-carboxylate
Compound characteristics
| Compound ID: | 8013-2308 |
| Compound Name: | methyl 2-(benzenesulfonyl)-3-(trifluoromethyl)-2-azabicyclo[2.2.1]hept-5-ene-3-carboxylate |
| Molecular Weight: | 361.34 |
| Molecular Formula: | C15 H14 F3 N O4 S |
| Smiles: | COC(C1(C2CC(C=C2)N1S(c1ccccc1)(=O)=O)C(F)(F)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.2263 |
| logD: | 3.2263 |
| logSw: | -3.5746 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.21 |
| InChI Key: | YIXUIFBSFAJCOS-UHFFFAOYSA-N |