N-(5-chloro-2-methylphenyl)-3-phenylpyrrolidine-1-carbothioamide
Chemical Structure Depiction of
N-(5-chloro-2-methylphenyl)-3-phenylpyrrolidine-1-carbothioamide
N-(5-chloro-2-methylphenyl)-3-phenylpyrrolidine-1-carbothioamide
Compound characteristics
| Compound ID: | K788-0624 |
| Compound Name: | N-(5-chloro-2-methylphenyl)-3-phenylpyrrolidine-1-carbothioamide |
| Molecular Weight: | 330.88 |
| Molecular Formula: | C18 H19 Cl N2 S |
| Smiles: | Cc1ccc(cc1NC(N1CCC(C1)c1ccccc1)=S)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2921 |
| logD: | 5.2921 |
| logSw: | -6.0545 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 10.4668 |
| InChI Key: | IVKKTHHOCWGGHX-OAHLLOKOSA-N |