3-(4-bromobenzene-1-sulfonyl)-N-[4-({1,3-dioxo-2-[2-(trifluoromethyl)phenyl]-2,3-dihydro-1H-isoindol-5-yl}oxy)phenyl]propanamide
Chemical Structure Depiction of
3-(4-bromobenzene-1-sulfonyl)-N-[4-({1,3-dioxo-2-[2-(trifluoromethyl)phenyl]-2,3-dihydro-1H-isoindol-5-yl}oxy)phenyl]propanamide
3-(4-bromobenzene-1-sulfonyl)-N-[4-({1,3-dioxo-2-[2-(trifluoromethyl)phenyl]-2,3-dihydro-1H-isoindol-5-yl}oxy)phenyl]propanamide
Compound characteristics
Compound ID: | K906-0049 |
Compound Name: | 3-(4-bromobenzene-1-sulfonyl)-N-[4-({1,3-dioxo-2-[2-(trifluoromethyl)phenyl]-2,3-dihydro-1H-isoindol-5-yl}oxy)phenyl]propanamide |
Molecular Weight: | 673.46 |
Molecular Formula: | C30 H20 Br F3 N2 O6 S |
Smiles: | C(CS(c1ccc(cc1)[Br])(=O)=O)C(Nc1ccc(cc1)Oc1ccc2C(N(C(c2c1)=O)c1ccccc1C(F)(F)F)=O)=O |
Stereo: | ACHIRAL |
logP: | 6.3396 |
logD: | 6.3396 |
logSw: | -5.9997 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 87.241 |
InChI Key: | VVTKNHQRYZBRLC-UHFFFAOYSA-N |