benzyl (2,2,2-trichloro-1-{[(4-fluorophenyl)carbamothioyl]amino}ethyl)carbamate
Chemical Structure Depiction of
benzyl (2,2,2-trichloro-1-{[(4-fluorophenyl)carbamothioyl]amino}ethyl)carbamate
benzyl (2,2,2-trichloro-1-{[(4-fluorophenyl)carbamothioyl]amino}ethyl)carbamate
Compound characteristics
| Compound ID: | 0319-0070 |
| Compound Name: | benzyl (2,2,2-trichloro-1-{[(4-fluorophenyl)carbamothioyl]amino}ethyl)carbamate |
| Molecular Weight: | 450.74 |
| Molecular Formula: | C17 H15 Cl3 F N3 O2 S |
| Smiles: | C(c1ccccc1)OC(NC(C([Cl])([Cl])[Cl])NC(Nc1ccc(cc1)F)=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0866 |
| logD: | 4.8796 |
| logSw: | -5.3459 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 51.816 |
| InChI Key: | LAQGRWPEOFXCKF-AWEZNQCLSA-N |