N-[4-({1,3-dioxo-2-[2-(trifluoromethyl)phenyl]-2,3-dihydro-1H-isoindol-5-yl}oxy)phenyl]-3-(4-methylbenzene-1-sulfonyl)propanamide
Chemical Structure Depiction of
N-[4-({1,3-dioxo-2-[2-(trifluoromethyl)phenyl]-2,3-dihydro-1H-isoindol-5-yl}oxy)phenyl]-3-(4-methylbenzene-1-sulfonyl)propanamide
N-[4-({1,3-dioxo-2-[2-(trifluoromethyl)phenyl]-2,3-dihydro-1H-isoindol-5-yl}oxy)phenyl]-3-(4-methylbenzene-1-sulfonyl)propanamide
Compound characteristics
| Compound ID: | K906-0044 |
| Compound Name: | N-[4-({1,3-dioxo-2-[2-(trifluoromethyl)phenyl]-2,3-dihydro-1H-isoindol-5-yl}oxy)phenyl]-3-(4-methylbenzene-1-sulfonyl)propanamide |
| Molecular Weight: | 608.59 |
| Molecular Formula: | C31 H23 F3 N2 O6 S |
| Smiles: | Cc1ccc(cc1)S(CCC(Nc1ccc(cc1)Oc1ccc2C(N(C(c2c1)=O)c1ccccc1C(F)(F)F)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9291 |
| logD: | 5.9291 |
| logSw: | -5.5403 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.241 |
| InChI Key: | HOWPJJONDYAUHW-UHFFFAOYSA-N |