N-(2-chloro-4-methylphenyl)-3-phenylpyrrolidine-1-carbothioamide
Chemical Structure Depiction of
N-(2-chloro-4-methylphenyl)-3-phenylpyrrolidine-1-carbothioamide
N-(2-chloro-4-methylphenyl)-3-phenylpyrrolidine-1-carbothioamide
Compound characteristics
| Compound ID: | K788-0638 |
| Compound Name: | N-(2-chloro-4-methylphenyl)-3-phenylpyrrolidine-1-carbothioamide |
| Molecular Weight: | 330.88 |
| Molecular Formula: | C18 H19 Cl N2 S |
| Smiles: | Cc1ccc(c(c1)[Cl])NC(N1CCC(C1)c1ccccc1)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5588 |
| logD: | 5.5588 |
| logSw: | -6.0846 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 10.4668 |
| InChI Key: | CSJVNRFDBUOBAF-OAHLLOKOSA-N |