3-phenyl-N-[2,2,2-trichloro-1-({[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}amino)ethyl]prop-2-enamide
Chemical Structure Depiction of
3-phenyl-N-[2,2,2-trichloro-1-({[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}amino)ethyl]prop-2-enamide
3-phenyl-N-[2,2,2-trichloro-1-({[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}amino)ethyl]prop-2-enamide
Compound characteristics
| Compound ID: | 0687-1009 |
| Compound Name: | 3-phenyl-N-[2,2,2-trichloro-1-({[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}amino)ethyl]prop-2-enamide |
| Molecular Weight: | 531.21 |
| Molecular Formula: | C19 H14 Cl4 F3 N3 O S |
| Smiles: | C(=C/c1ccccc1)\C(NC(C([Cl])([Cl])[Cl])NC(Nc1cc(ccc1[Cl])C(F)(F)F)=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3347 |
| logD: | 6.2638 |
| logSw: | -6.533 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 42.449 |
| InChI Key: | QSFWPYXFUWEAHA-INIZCTEOSA-N |