1-{2-ethyl-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]benzene-1-sulfonyl}-1,2,3,4-tetrahydroquinoline
Chemical Structure Depiction of
1-{2-ethyl-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]benzene-1-sulfonyl}-1,2,3,4-tetrahydroquinoline
1-{2-ethyl-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]benzene-1-sulfonyl}-1,2,3,4-tetrahydroquinoline
Compound characteristics
Compound ID: | M086-1345 |
Compound Name: | 1-{2-ethyl-5-[5-(trifluoromethyl)-1,2-oxazol-3-yl]benzene-1-sulfonyl}-1,2,3,4-tetrahydroquinoline |
Molecular Weight: | 436.45 |
Molecular Formula: | C21 H19 F3 N2 O3 S |
Smiles: | CCc1ccc(cc1S(N1CCCc2ccccc12)(=O)=O)c1cc(C(F)(F)F)on1 |
Stereo: | ACHIRAL |
logP: | 5.3894 |
logD: | 5.3894 |
logSw: | -5.4014 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 52.926 |
InChI Key: | LXLGAPYFGVHEFH-UHFFFAOYSA-N |