4-[(2-chloro-6-fluorophenyl)methyl]-N-[3-(methylsulfanyl)phenyl]piperazine-1-carboxamide
Chemical Structure Depiction of
4-[(2-chloro-6-fluorophenyl)methyl]-N-[3-(methylsulfanyl)phenyl]piperazine-1-carboxamide
4-[(2-chloro-6-fluorophenyl)methyl]-N-[3-(methylsulfanyl)phenyl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | Y206-2870 |
| Compound Name: | 4-[(2-chloro-6-fluorophenyl)methyl]-N-[3-(methylsulfanyl)phenyl]piperazine-1-carboxamide |
| Molecular Weight: | 393.91 |
| Molecular Formula: | C19 H21 Cl F N3 O S |
| Smiles: | CSc1cccc(c1)NC(N1CCN(CC1)Cc1c(cccc1[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.869 |
| logD: | 3.8263 |
| logSw: | -4.2411 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.248 |
| InChI Key: | CRZVCPSDAMAAOF-UHFFFAOYSA-N |