3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{[3-(trifluoromethyl)phenyl]carbamothioyl}propanamide
Chemical Structure Depiction of
3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{[3-(trifluoromethyl)phenyl]carbamothioyl}propanamide
3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{[3-(trifluoromethyl)phenyl]carbamothioyl}propanamide
Compound characteristics
| Compound ID: | 5596-0141 |
| Compound Name: | 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{[3-(trifluoromethyl)phenyl]carbamothioyl}propanamide |
| Molecular Weight: | 421.4 |
| Molecular Formula: | C19 H14 F3 N3 O3 S |
| Smiles: | C(CN1C(c2ccccc2C1=O)=O)C(NC(Nc1cccc(c1)C(F)(F)F)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.37 |
| logD: | 3.3614 |
| logSw: | -3.8091 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.529 |
| InChI Key: | ZGCSOHOVKUFHGQ-UHFFFAOYSA-N |