Guanidine, N-(3-(1H-imidazol-1-yl)propyl)-N'-(2-(((5-methyl-1H-imidazol-4-yl)methyl)thio)ethyl)-, trihydrochloride
TL;DR: Guanidine, N-(3-(1H-imidazol-1-yl)propyl)-N'-(2-(((5-methyl-1H-imidazol-4-yl)methyl)thio)ethyl)-, trihydrochloride (CAS 83222-98-4) is a chemical compound with molecular formula C14H26Cl3N7S and molecular weight 429.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-imidazol-1-ylpropyl)-1-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]guanidine;trihydrochloride
Also Known As: Guanidine, N-(3-(1H-imidazol-1-yl)propyl)-N'-(2-(((5-methyl-1H-imidazol-4-yl)methyl)thio)ethyl)-, trihydrochloride, 2-(3-imidazol-1-ylpropyl)-1-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]guanidine trihydrochloride, N''-[3-(1H-Imidazol-1-yl)propyl]-N-(2-{[(5-methyl-1H-imidazol-4-yl)methyl]sulfanyl}ethyl)guanidine--hydrogen chloride (1/3), RefChem:347026
| Molecular Formula | C14H26Cl3N7S |
|---|---|
| Molecular Weight | 429.10 g/mol |
| LogP | 2.40782 |
| Topological Polar Surface Area | 96.91 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 429.1036 |
| Heavy Atoms | 25 |
| Complexity | 574.7522 |
Chemical Identifiers
| CAS Number | 83222-98-4 |
|---|---|
| SMILES | CC1=C(N=CN1)CSCCNC(=NCCCN2C=CN=C2)N.Cl.Cl.Cl |
Product Overview
Guanidine, N-(3-(1H-imidazol-1-yl)propyl)-N'-(2-(((5-methyl-1H-imidazol-4-yl)methyl)thio)ethyl)-, trihydrochloride (CAS 83222-98-4), with molecular formula C14H26Cl3N7S and molecular weight 429.10 g/mol. IUPAC: 2-(3-imidazol-1-ylpropyl)-1-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]guanidine;trihydrochloride.
Chemical Property Profile of Guanidine, N-(3-(1H-imidazol-1-yl)propyl)-N'-(2-(((5-methyl-1H-imidazol-4-yl)methyl)thio)ethyl)-, trihydrochloride
Property Insights of Guanidine, N-(3-(1H-imidazol-1-yl)propyl)-N'-(2-(((5-methyl-1H-imidazol-4-yl)methyl)thio)ethyl)-, trihydrochloride
The XLogP value of 2.40782 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Guanidine, N-(3-(1H-imidazol-1-yl)propyl)-N'-(2-(((5-methyl-1H-imidazol-4-yl)methyl)thio)ethyl)-, trihydrochloride. The TPSA of 96.91 Ų falls within the moderate polarity range, balancing permeability and solubility for Guanidine, N-(3-(1H-imidazol-1-yl)propyl)-N'-(2-(((5-methyl-1H-imidazol-4-yl)methyl)thio)ethyl)-, trihydrochloride. Following Lipinski's Rule of Five, Guanidine, N-(3-(1H-imidazol-1-yl)propyl)-N'-(2-(((5-methyl-1H-imidazol-4-yl)methyl)thio)ethyl)-, trihydrochloride has 3 hydrogen bond donor(s) and 4 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 Guanidine, N-(3-(1H-imidazol-1-yl)propyl)-N'-(2-(((5-methyl-1H-imidazol-4-yl)methyl)thio)ethyl)-, trihydrochloride?
The CAS number of Guanidine, N-(3-(1H-imidazol-1-yl)propyl)-N'-(2-(((5-methyl-1H-imidazol-4-yl)methyl)thio)ethyl)-, trihydrochloride is 83222-98-4.
What is the molecular formula of Guanidine, N-(3-(1H-imidazol-1-yl)propyl)-N'-(2-(((5-methyl-1H-imidazol-4-yl)methyl)thio)ethyl)-, trihydrochloride?
The molecular formula of Guanidine, N-(3-(1H-imidazol-1-yl)propyl)-N'-(2-(((5-methyl-1H-imidazol-4-yl)methyl)thio)ethyl)-, trihydrochloride is C14H26Cl3N7S.
What is the molecular weight of Guanidine, N-(3-(1H-imidazol-1-yl)propyl)-N'-(2-(((5-methyl-1H-imidazol-4-yl)methyl)thio)ethyl)-, trihydrochloride?
The molecular weight of Guanidine, N-(3-(1H-imidazol-1-yl)propyl)-N'-(2-(((5-methyl-1H-imidazol-4-yl)methyl)thio)ethyl)-, trihydrochloride is 429.10 g/mol.
Where can I buy Guanidine, N-(3-(1H-imidazol-1-yl)propyl)-N'-(2-(((5-methyl-1H-imidazol-4-yl)methyl)thio)ethyl)-, trihydrochloride?
You can request a quote for Guanidine, N-(3-(1H-imidazol-1-yl)propyl)-N'-(2-(((5-methyl-1H-imidazol-4-yl)methyl)thio)ethyl)-, trihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Guanidine, N-(3-(1H-imidazol-1-yl)propyl)-N'-(2-(((5-methyl-1H-imidazol-4-yl)methyl)thio)ethyl)-, trihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Guanidine, N-(3-(1H-imidazol-1-yl)propyl)-N'-(2-(((5-methyl-1H-imidazol-4-yl)methyl)thio)ethyl)-, trihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.