N-[2,2,2-trichloro-1-({[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}amino)ethyl]butanamide
Chemical Structure Depiction of
N-[2,2,2-trichloro-1-({[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}amino)ethyl]butanamide
N-[2,2,2-trichloro-1-({[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}amino)ethyl]butanamide
Compound characteristics
| Compound ID: | 1501-0270 |
| Compound Name: | N-[2,2,2-trichloro-1-({[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}amino)ethyl]butanamide |
| Molecular Weight: | 471.15 |
| Molecular Formula: | C14 H14 Cl4 F3 N3 O S |
| Smiles: | CCCC(NC(C([Cl])([Cl])[Cl])NC(Nc1cc(ccc1[Cl])C(F)(F)F)=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0736 |
| logD: | 4.9769 |
| logSw: | -5.5173 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 42.72 |
| InChI Key: | QNDYSYRUMITLFX-NSHDSACASA-N |