硫酸胍唑啶
TL;DR: 硫酸胍唑啶 (CAS 42839-36-1) is a chemical compound with molecular formula C9H22N4O4S and molecular weight 282.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
硫酸胍唑啶
2-(azocan-2-ylmethyl)guanidine;sulfuric acid
Also Known As: guanazodine sulfate, Calnegyt, Sanegyt, Egyt 739, Guanazodine sulfate anhydrous
| Molecular Formula | C9H22N4O4S |
|---|---|
| Molecular Weight | 282.14 g/mol |
| LogP | -0.4707 |
| Topological Polar Surface Area | 159.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 282.13617 |
| Heavy Atoms | 18 |
| Complexity | 244.0 |
Chemical Identifiers
| CAS Number | 42839-36-1 |
|---|---|
| SMILES | C1CCCNC(CC1)CN=C(N)N.OS(=O)(=O)O |
| InChIKey | FKAIWDBDCWVRIG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
硫酸胍唑啶 (CAS 42839-36-1), with molecular formula C9H22N4O4S and molecular weight 282.14 g/mol. IUPAC: 2-(azocan-2-ylmethyl)guanidine;sulfuric acid.
Chemical Property Profile of 硫酸胍唑啶
Property Insights of 硫酸胍唑啶
The XLogP value of -0.4707 indicates that 硫酸胍唑啶 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 159.0 Ų indicates high polarity, suggesting 硫酸胍唑啶 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 硫酸胍唑啶 has 5 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 硫酸胍唑啶?
The CAS number of 硫酸胍唑啶 is 42839-36-1.
What is the molecular formula of 硫酸胍唑啶?
The molecular formula of 硫酸胍唑啶 is C9H22N4O4S.
What is the molecular weight of 硫酸胍唑啶?
The molecular weight of 硫酸胍唑啶 is 282.14 g/mol.
Where can I buy 硫酸胍唑啶?
You can request a quote for 硫酸胍唑啶 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 硫酸胍唑啶?
Yes, KEHONG BIO provides custom synthesis services for 硫酸胍唑啶 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.