TL;DR: 4-((4-Chlorophenyl)thio)piperidine (CAS 101768-81-4) is a chemical compound with molecular formula C11H14ClNS and molecular weight 227.05354 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(4-chlorophenyl)sulfanylpiperidine
Also Known As: 4-((4-Chlorophenyl)thio)piperidine, 4-[(4-chlorophenyl)sulfanyl]piperidine, 4-(4-chlorophenyl)sulfanylpiperidine, 4-(4-CHLORO-PHENYLSULFANYL)-PIPERIDINE, 4-(p-chlorophenylthio)piperidine
| Molecular Formula | C11H14ClNS |
| Molecular Weight | 227.05354 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 227.05354 Da |
| Heavy Atoms | 14 |
| Complexity | 163.0 |
| SMILES | C1CNCCC1SC2=CC=C(C=C2)Cl |
| InChIKey | DORGHGOWHFHJPG-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that 4-((4-Chlorophenyl)thio)piperidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 4-((4-Chlorophenyl)thio)piperidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-((4-Chlorophenyl)thio)piperidine has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-((4-Chlorophenyl)thio)piperidine is 101768-81-4.
The molecular formula of 4-((4-Chlorophenyl)thio)piperidine is C11H14ClNS.
The molecular weight of 4-((4-Chlorophenyl)thio)piperidine is 227.05354 g/mol.
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