Methanohexohydroisoindoline ethylguanidine hemisulfate
TL;DR: Methanohexohydroisoindoline ethylguanidine hemisulfate (CAS 21073-23-4) is a chemical compound with molecular formula C24H46N8O4S and molecular weight 542.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-[2-[(1R,2R,6S,7S)-4-azatricyclo[5.2.1.02,6]decan-4-yl]ethyl]guanidine);sulfuric acid
Also Known As: Methanohexohydroisoindoline ethylguanidine hemisulfate, Cid 3082181, 2-[2-[(1R,2R,6S,7S)-4-azatricyclo[5.2.1.02,6]decan-4-yl]ethyl]guanidine;sulfuric acid, Guanidine, (2-(octahydro-4,7-methano-2H-isoindol-2-yl)ethyl)-, (3aalpha,4alpha,7alpha,7aalpha)-, sulfate (2:1), Guanidine,(2-(octahydro-4,7-methano-2H-isoindol-2-yl)ethyl)-,(3aalpha,4alpha,7alpha,7aalpha)-,sulfate (2:1)
| Molecular Formula | C24H46N8O4S |
|---|---|
| Molecular Weight | 542.34 g/mol |
| LogP | -0.1774 |
| Topological Polar Surface Area | 209.88 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 542.33624 |
| Heavy Atoms | 37 |
| Complexity | 835.0335 |
Chemical Identifiers
| CAS Number | 21073-23-4 |
|---|---|
| SMILES | C1C[C@H]2C[C@@H]1[C@@H]3[C@H]2CN(C3)CCN=C(N)N.C1C[C@H]2C[C@@H]1[C@@H]3[C@H]2CN(C3)CCN=C(N)N.OS(=O)(=O)O |
Product Overview
Methanohexohydroisoindoline ethylguanidine hemisulfate (CAS 21073-23-4), with molecular formula C24H46N8O4S and molecular weight 542.34 g/mol. IUPAC: bis(2-[2-[(1R,2R,6S,7S)-4-azatricyclo[5.2.1.02,6]decan-4-yl]ethyl]guanidine);sulfuric acid.
Chemical Property Profile of Methanohexohydroisoindoline ethylguanidine hemisulfate
Property Insights of Methanohexohydroisoindoline ethylguanidine hemisulfate
The XLogP value of -0.1774 indicates that Methanohexohydroisoindoline ethylguanidine hemisulfate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 209.88 Ų indicates high polarity, suggesting Methanohexohydroisoindoline ethylguanidine hemisulfate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Methanohexohydroisoindoline ethylguanidine hemisulfate has 6 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methanohexohydroisoindoline ethylguanidine hemisulfate?
The CAS number of Methanohexohydroisoindoline ethylguanidine hemisulfate is 21073-23-4.
What is the molecular formula of Methanohexohydroisoindoline ethylguanidine hemisulfate?
The molecular formula of Methanohexohydroisoindoline ethylguanidine hemisulfate is C24H46N8O4S.
What is the molecular weight of Methanohexohydroisoindoline ethylguanidine hemisulfate?
The molecular weight of Methanohexohydroisoindoline ethylguanidine hemisulfate is 542.34 g/mol.
Where can I buy Methanohexohydroisoindoline ethylguanidine hemisulfate?
You can request a quote for Methanohexohydroisoindoline ethylguanidine hemisulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methanohexohydroisoindoline ethylguanidine hemisulfate?
Yes, KEHONG BIO provides custom synthesis services for Methanohexohydroisoindoline ethylguanidine hemisulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.