Guvacoline
TL;DR: Guvacoline (CAS 5446-64-0) is a chemical compound with molecular formula C7H11NO2 and molecular weight 141.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1,2,3,6-tetrahydropyridine-5-carboxylate
Also Known As: Guvacoline, Norarecoline, guavacoline, Guvacine methyl ester, methyl 1,2,5,6-tetrahydropyridine-3-carboxylate
| Molecular Formula | C7H11NO2 |
|---|---|
| Molecular Weight | 141.08 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 141.07898 |
| Heavy Atoms | 10 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 5446-64-0 |
|---|---|
| SMILES | COC(=O)C1=CCCNC1 |
| InChIKey | DYPLDWLIOGXSSE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Guvacoline (CAS 5446-64-0), with molecular formula C7H11NO2 and molecular weight 141.08 g/mol. IUPAC: methyl 1,2,3,6-tetrahydropyridine-5-carboxylate.
Chemical Property Profile of Guvacoline
Property Insights of Guvacoline
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Guvacoline. With a topological polar surface area (TPSA) of 38.3 Ų, Guvacoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Guvacoline has 1 hydrogen bond donor(s) and 3 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 Guvacoline?
The CAS number of Guvacoline is 5446-64-0.
What is the molecular formula of Guvacoline?
The molecular formula of Guvacoline is C7H11NO2.
What is the molecular weight of Guvacoline?
The molecular weight of Guvacoline is 141.08 g/mol.
Where can I buy Guvacoline?
You can request a quote for Guvacoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Guvacoline?
Yes, KEHONG BIO provides custom synthesis services for Guvacoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.