N-[(2-chloro-4-fluorophenyl)methyl]-1-[3-(phenylsulfanyl)pyrazin-2-yl]piperidine-3-carboxamide
Chemical Structure Depiction of
N-[(2-chloro-4-fluorophenyl)methyl]-1-[3-(phenylsulfanyl)pyrazin-2-yl]piperidine-3-carboxamide
N-[(2-chloro-4-fluorophenyl)methyl]-1-[3-(phenylsulfanyl)pyrazin-2-yl]piperidine-3-carboxamide
Compound characteristics
| Compound ID: | L895-0408 |
| Compound Name: | N-[(2-chloro-4-fluorophenyl)methyl]-1-[3-(phenylsulfanyl)pyrazin-2-yl]piperidine-3-carboxamide |
| Molecular Weight: | 456.97 |
| Molecular Formula: | C23 H22 Cl F N4 O S |
| Smiles: | C1CC(CN(C1)c1c(nccn1)Sc1ccccc1)C(NCc1ccc(cc1[Cl])F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7466 |
| logD: | 4.7465 |
| logSw: | -5.0048 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.926 |
| InChI Key: | VHQQCEDDLMTCFS-KRWDZBQOSA-N |