Guanoctine Hydrochloride
TL;DR: Guanoctine Hydrochloride (CAS 1070-95-7) is a chemical compound with molecular formula C9H22ClN3 and molecular weight 207.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,4,4-trimethylpentan-2-yl)guanidine;hydrochloride
Also Known As: Guanoctine HCl, GUANOCTINE HYDROCHLORIDE, starbld0001534, Guanoctine hydrochloride [USAN], Guanoctine (hydrochloride)
| Molecular Formula | C9H22ClN3 |
|---|---|
| Molecular Weight | 207.15 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 207.15022 |
| Heavy Atoms | 13 |
| Complexity | 171.0 |
Chemical Identifiers
| CAS Number | 1070-95-7 |
|---|---|
| SMILES | CC(C)(C)CC(C)(C)N=C(N)N.Cl |
| InChIKey | QRFSLMLESAIOMB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Guanoctine Hydrochloride (CAS 1070-95-7), with molecular formula C9H22ClN3 and molecular weight 207.15 g/mol. IUPAC: 2-(2,4,4-trimethylpentan-2-yl)guanidine;hydrochloride.
Chemical Property Profile of Guanoctine Hydrochloride
Property Insights of Guanoctine Hydrochloride
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Guanoctine Hydrochloride. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Guanoctine Hydrochloride. Following Lipinski's Rule of Five, Guanoctine Hydrochloride has 3 hydrogen bond donor(s) and 1 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 Guanoctine Hydrochloride?
The CAS number of Guanoctine Hydrochloride is 1070-95-7.
What is the molecular formula of Guanoctine Hydrochloride?
The molecular formula of Guanoctine Hydrochloride is C9H22ClN3.
What is the molecular weight of Guanoctine Hydrochloride?
The molecular weight of Guanoctine Hydrochloride is 207.15 g/mol.
Where can I buy Guanoctine Hydrochloride?
You can request a quote for Guanoctine Hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Guanoctine Hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Guanoctine Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.