N-(3-chloro-4-fluorophenyl)-3-(4-methylphenyl)pyrrolidine-1-carbothioamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-3-(4-methylphenyl)pyrrolidine-1-carbothioamide
N-(3-chloro-4-fluorophenyl)-3-(4-methylphenyl)pyrrolidine-1-carbothioamide
Compound characteristics
| Compound ID: | K788-7588 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-3-(4-methylphenyl)pyrrolidine-1-carbothioamide |
| Molecular Weight: | 348.87 |
| Molecular Formula: | C18 H18 Cl F N2 S |
| Smiles: | Cc1ccc(cc1)C1CCN(C1)C(Nc1ccc(c(c1)[Cl])F)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6406 |
| logD: | 5.6404 |
| logSw: | -6.1949 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 11.1646 |
| InChI Key: | RKQOMUGIHDNTNT-CQSZACIVSA-N |