N-[2,2,2-trichloro-1-({[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}amino)ethyl]furan-2-carboxamide
Chemical Structure Depiction of
N-[2,2,2-trichloro-1-({[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}amino)ethyl]furan-2-carboxamide
N-[2,2,2-trichloro-1-({[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}amino)ethyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | 1501-0138 |
| Compound Name: | N-[2,2,2-trichloro-1-({[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}amino)ethyl]furan-2-carboxamide |
| Molecular Weight: | 495.13 |
| Molecular Formula: | C15 H10 Cl4 F3 N3 O2 S |
| Smiles: | c1cc(C(NC(C([Cl])([Cl])[Cl])NC(Nc2cc(ccc2[Cl])C(F)(F)F)=S)=O)oc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8872 |
| logD: | 4.4363 |
| logSw: | -5.1765 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 51.24 |
| InChI Key: | RVCULPGPQOPAPR-LBPRGKRZSA-N |