Gacyclidine
TL;DR: Gacyclidine (CAS 160113-33-7) is a chemical compound with molecular formula C16H25NS and molecular weight 263.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(1R,2S)-2-methyl-1-thiophen-2-ylcyclohexyl]piperidine
Also Known As: Gacyclidine, gaciclidina, gacyclidinum, Gacyclidine [INN], (+)-Gacyclidine
| Molecular Formula | C16H25NS |
|---|---|
| Molecular Weight | 263.17 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 31.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 263.17078 |
| Heavy Atoms | 18 |
| Complexity | 274.0 |
Chemical Identifiers
| CAS Number | 160113-33-7 |
|---|---|
| SMILES | C[C@H]1CCCC[C@@]1(C2=CC=CS2)N3CCCCC3 |
| InChIKey | DKFAAPPUYWQKKF-GOEBONIOSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Gacyclidine (CAS 160113-33-7), with molecular formula C16H25NS and molecular weight 263.17 g/mol. IUPAC: 1-[(1R,2S)-2-methyl-1-thiophen-2-ylcyclohexyl]piperidine.
Chemical Property Profile of Gacyclidine
Property Insights of Gacyclidine
The XLogP value of 4.4 indicates that Gacyclidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.5 Ų, Gacyclidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Gacyclidine has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Gacyclidine?
The CAS number of Gacyclidine is 160113-33-7.
What is the molecular formula of Gacyclidine?
The molecular formula of Gacyclidine is C16H25NS.
What is the molecular weight of Gacyclidine?
The molecular weight of Gacyclidine is 263.17 g/mol.
Where can I buy Gacyclidine?
You can request a quote for Gacyclidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Gacyclidine?
Yes, KEHONG BIO provides custom synthesis services for Gacyclidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.