2-[(4-bromophenyl)sulfanyl]-N-[4-({1,3-dioxo-2-[2-(trifluoromethyl)phenyl]-2,3-dihydro-1H-isoindol-5-yl}oxy)phenyl]acetamide
Chemical Structure Depiction of
2-[(4-bromophenyl)sulfanyl]-N-[4-({1,3-dioxo-2-[2-(trifluoromethyl)phenyl]-2,3-dihydro-1H-isoindol-5-yl}oxy)phenyl]acetamide
2-[(4-bromophenyl)sulfanyl]-N-[4-({1,3-dioxo-2-[2-(trifluoromethyl)phenyl]-2,3-dihydro-1H-isoindol-5-yl}oxy)phenyl]acetamide
Compound characteristics
| Compound ID: | K842-0033 |
| Compound Name: | 2-[(4-bromophenyl)sulfanyl]-N-[4-({1,3-dioxo-2-[2-(trifluoromethyl)phenyl]-2,3-dihydro-1H-isoindol-5-yl}oxy)phenyl]acetamide |
| Molecular Weight: | 627.44 |
| Molecular Formula: | C29 H18 Br F3 N2 O4 S |
| Smiles: | C(C(Nc1ccc(cc1)Oc1ccc2C(N(C(c2c1)=O)c1ccccc1C(F)(F)F)=O)=O)Sc1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 7.5865 |
| logD: | 7.5865 |
| logSw: | -6.1345 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.204 |
| InChI Key: | YSQPJRADRYOMLT-UHFFFAOYSA-N |