2-3-1- guanidinehydrochloride
TL;DR: 2-3-1- guanidinehydrochloride (CAS 72042-01-4) is a chemical compound with molecular formula C24H32ClN5S and molecular weight 457.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,3-diethylcyclohexyl)-1-(2-methylquinolin-4-yl)-3-(1,3-thiazol-2-yl)guanidine;hydrochloride
Also Known As: 2-3-1- guanidinehydrochloride, 2- -3- -1- guanidinehydrochloride, Guanidine, N-(2,3-diethylcyclohexyl)-N'-(2-methyl-4-quinolinyl)-N''-2-thiazolyl-, monohydrochloride, Guanidine, 1-(2,3-dimethylcyclohexyl)-2-(2-methyll-4-quinolyl)-3-(2-thiazolyl)-, hydrochloride, 2-(2,3-diethylcyclohexyl)-1-(2-methylquinolin-4-yl)-3-(1,3-thiazol-2-yl)guanidine hydrochloride
| Molecular Formula | C24H32ClN5S |
|---|---|
| Molecular Weight | 457.21 g/mol |
| LogP | 6.90642 |
| Topological Polar Surface Area | 62.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 457.2067 |
| Heavy Atoms | 31 |
| Complexity | 1004.38214 |
Chemical Identifiers
| CAS Number | 72042-01-4 |
|---|---|
| SMILES | CCC1CCCC(C1CC)N=C(NC2=CC(=NC3=CC=CC=C32)C)NC4=NC=CS4.Cl |
Product Overview
2-3-1- guanidinehydrochloride (CAS 72042-01-4), with molecular formula C24H32ClN5S and molecular weight 457.21 g/mol. IUPAC: 2-(2,3-diethylcyclohexyl)-1-(2-methylquinolin-4-yl)-3-(1,3-thiazol-2-yl)guanidine;hydrochloride.
Chemical Property Profile of 2-3-1- guanidinehydrochloride
Property Insights of 2-3-1- guanidinehydrochloride
The XLogP value of 6.90642 indicates that 2-3-1- guanidinehydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-3-1- guanidinehydrochloride. Following Lipinski's Rule of Five, 2-3-1- guanidinehydrochloride has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-3-1- guanidinehydrochloride?
The CAS number of 2-3-1- guanidinehydrochloride is 72042-01-4.
What is the molecular formula of 2-3-1- guanidinehydrochloride?
The molecular formula of 2-3-1- guanidinehydrochloride is C24H32ClN5S.
What is the molecular weight of 2-3-1- guanidinehydrochloride?
The molecular weight of 2-3-1- guanidinehydrochloride is 457.21 g/mol.
Where can I buy 2-3-1- guanidinehydrochloride?
You can request a quote for 2-3-1- guanidinehydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-3-1- guanidinehydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2-3-1- guanidinehydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.