Guanidine, (2-(1,8,8-trimethyl-3-azabicyclo(3.2.1)oct-3-yl)ethyl)-, sulfate
TL;DR: Guanidine, (2-(1,8,8-trimethyl-3-azabicyclo(3.2.1)oct-3-yl)ethyl)-, sulfate (CAS 2847-69-0) is a chemical compound with molecular formula C13H28N4O4S and molecular weight 336.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sulfuric acid;2-[2-(1,8,8-trimethyl-3-azabicyclo[3.2.1]octan-3-yl)ethyl]guanidine
Also Known As: (2-(1,8,8-Trimethyl-3-azabicyclo(3.2.1)oct-3-yl)ethyl)guanidine sulfate, Guanidine, (2-(1,8,8-trimethyl-3-azabicyclo(3.2.1)oct-3-yl)ethyl)-, sulfate, SULFURIC ACID; 2-[2-(1,8,8-TRIMETHYL-3-AZABICYCLO[3.2.1]OCT-3-YL)ETHYL]GUANIDINE, sulfuric acid; 2-[2-(5,8,8-trimethyl-3-azabicyclo[3.2.1]octan-3-yl)ethyl]guanidine, Sulfuric acid--N-[2-(1,8,8-trimethyl-3-azabicyclo[3.2.1]octan-3-yl)ethyl]guanidine (1/1)
| Molecular Formula | C13H28N4O4S |
|---|---|
| Molecular Weight | 336.18 g/mol |
| LogP | 0.3651 |
| Topological Polar Surface Area | 151.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 336.18314 |
| Heavy Atoms | 22 |
| Complexity | 401.0 |
Chemical Identifiers
| CAS Number | 2847-69-0 |
|---|---|
| SMILES | CC1(C2CCC1(CN(C2)CCN=C(N)N)C)C.OS(=O)(=O)O |
| InChIKey | WODQGIOISXFCTG-UHFFFAOYSA-N |
Product Overview
Guanidine, (2-(1,8,8-trimethyl-3-azabicyclo(3.2.1)oct-3-yl)ethyl)-, sulfate (CAS 2847-69-0), with molecular formula C13H28N4O4S and molecular weight 336.18 g/mol. IUPAC: sulfuric acid;2-[2-(1,8,8-trimethyl-3-azabicyclo[3.2.1]octan-3-yl)ethyl]guanidine.
Chemical Property Profile of Guanidine, (2-(1,8,8-trimethyl-3-azabicyclo(3.2.1)oct-3-yl)ethyl)-, sulfate
Property Insights of Guanidine, (2-(1,8,8-trimethyl-3-azabicyclo(3.2.1)oct-3-yl)ethyl)-, sulfate
The XLogP value of 0.3651 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Guanidine, (2-(1,8,8-trimethyl-3-azabicyclo(3.2.1)oct-3-yl)ethyl)-, sulfate. The TPSA of 151.0 Ų indicates high polarity, suggesting Guanidine, (2-(1,8,8-trimethyl-3-azabicyclo(3.2.1)oct-3-yl)ethyl)-, sulfate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Guanidine, (2-(1,8,8-trimethyl-3-azabicyclo(3.2.1)oct-3-yl)ethyl)-, sulfate has 4 hydrogen bond donor(s) and 6 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, (2-(1,8,8-trimethyl-3-azabicyclo(3.2.1)oct-3-yl)ethyl)-, sulfate?
The CAS number of Guanidine, (2-(1,8,8-trimethyl-3-azabicyclo(3.2.1)oct-3-yl)ethyl)-, sulfate is 2847-69-0.
What is the molecular formula of Guanidine, (2-(1,8,8-trimethyl-3-azabicyclo(3.2.1)oct-3-yl)ethyl)-, sulfate?
The molecular formula of Guanidine, (2-(1,8,8-trimethyl-3-azabicyclo(3.2.1)oct-3-yl)ethyl)-, sulfate is C13H28N4O4S.
What is the molecular weight of Guanidine, (2-(1,8,8-trimethyl-3-azabicyclo(3.2.1)oct-3-yl)ethyl)-, sulfate?
The molecular weight of Guanidine, (2-(1,8,8-trimethyl-3-azabicyclo(3.2.1)oct-3-yl)ethyl)-, sulfate is 336.18 g/mol.
Where can I buy Guanidine, (2-(1,8,8-trimethyl-3-azabicyclo(3.2.1)oct-3-yl)ethyl)-, sulfate?
You can request a quote for Guanidine, (2-(1,8,8-trimethyl-3-azabicyclo(3.2.1)oct-3-yl)ethyl)-, sulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Guanidine, (2-(1,8,8-trimethyl-3-azabicyclo(3.2.1)oct-3-yl)ethyl)-, sulfate?
Yes, KEHONG BIO provides custom synthesis services for Guanidine, (2-(1,8,8-trimethyl-3-azabicyclo(3.2.1)oct-3-yl)ethyl)-, sulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.