Thiosulfuric acid, S-(2-(((3-hydroxytricyclo(3.3.1.1(sup 3,7))dec-1-yl)methyl)amino)-2-iminoethyl) ester
TL;DR: Thiosulfuric acid, S-(2-(((3-hydroxytricyclo(3.3.1.1(sup 3,7))dec-1-yl)methyl)amino)-2-iminoethyl) ester (CAS 128487-66-1) is a chemical compound with molecular formula C13H22N2O4S2 and molecular weight 334.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[(1-amino-2-sulfosulfanylethylidene)amino]methyl]-3-hydroxyadamantane
Also Known As: Thiosulfuric acid, S-(2-(((3-hydroxytricyclo(3.3.1.1(sup 3,7))dec-1-yl)methyl)amino)-2-iminoethyl) ester, 1-[[(1-amino-2-sulfosulfanylethylidene)amino]methyl]-3-hydroxyadamantane, S-(2-{[(3-Hydroxyadamantan-1-yl)methyl]amino}-2-iminoethyl) hydrogen sulfurothioate, Thiosulfuric acid (H2S2O3), S-(2-(((3-hydroxytricyclo(3.3.1.13,7)dec-1-yl)methyl)amino)-2-iminoethyl) ester, RefChem:1100037
| Molecular Formula | C13H22N2O4S2 |
|---|---|
| Molecular Weight | 334.10 g/mol |
| LogP | 1.2109 |
| Topological Polar Surface Area | 112.98 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 334.1021 |
| Heavy Atoms | 21 |
| Complexity | 546.51855 |
Chemical Identifiers
| CAS Number | 128487-66-1 |
|---|---|
| SMILES | C1C2CC3(CC1CC(C2)(C3)O)CN=C(CSS(=O)(=O)O)N |
Product Overview
Thiosulfuric acid, S-(2-(((3-hydroxytricyclo(3.3.1.1(sup 3,7))dec-1-yl)methyl)amino)-2-iminoethyl) ester (CAS 128487-66-1), with molecular formula C13H22N2O4S2 and molecular weight 334.10 g/mol. IUPAC: 1-[[(1-amino-2-sulfosulfanylethylidene)amino]methyl]-3-hydroxyadamantane.
Chemical Property Profile of Thiosulfuric acid, S-(2-(((3-hydroxytricyclo(3.3.1.1(sup 3,7))dec-1-yl)methyl)amino)-2-iminoethyl) ester
Property Insights of Thiosulfuric acid, S-(2-(((3-hydroxytricyclo(3.3.1.1(sup 3,7))dec-1-yl)methyl)amino)-2-iminoethyl) ester
The XLogP value of 1.2109 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thiosulfuric acid, S-(2-(((3-hydroxytricyclo(3.3.1.1(sup 3,7))dec-1-yl)methyl)amino)-2-iminoethyl) ester. The TPSA of 112.98 Ų falls within the moderate polarity range, balancing permeability and solubility for Thiosulfuric acid, S-(2-(((3-hydroxytricyclo(3.3.1.1(sup 3,7))dec-1-yl)methyl)amino)-2-iminoethyl) ester. Following Lipinski's Rule of Five, Thiosulfuric acid, S-(2-(((3-hydroxytricyclo(3.3.1.1(sup 3,7))dec-1-yl)methyl)amino)-2-iminoethyl) ester has 3 hydrogen bond donor(s) and 5 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 Thiosulfuric acid, S-(2-(((3-hydroxytricyclo(3.3.1.1(sup 3,7))dec-1-yl)methyl)amino)-2-iminoethyl) ester?
The CAS number of Thiosulfuric acid, S-(2-(((3-hydroxytricyclo(3.3.1.1(sup 3,7))dec-1-yl)methyl)amino)-2-iminoethyl) ester is 128487-66-1.
What is the molecular formula of Thiosulfuric acid, S-(2-(((3-hydroxytricyclo(3.3.1.1(sup 3,7))dec-1-yl)methyl)amino)-2-iminoethyl) ester?
The molecular formula of Thiosulfuric acid, S-(2-(((3-hydroxytricyclo(3.3.1.1(sup 3,7))dec-1-yl)methyl)amino)-2-iminoethyl) ester is C13H22N2O4S2.
What is the molecular weight of Thiosulfuric acid, S-(2-(((3-hydroxytricyclo(3.3.1.1(sup 3,7))dec-1-yl)methyl)amino)-2-iminoethyl) ester?
The molecular weight of Thiosulfuric acid, S-(2-(((3-hydroxytricyclo(3.3.1.1(sup 3,7))dec-1-yl)methyl)amino)-2-iminoethyl) ester is 334.10 g/mol.
Where can I buy Thiosulfuric acid, S-(2-(((3-hydroxytricyclo(3.3.1.1(sup 3,7))dec-1-yl)methyl)amino)-2-iminoethyl) ester?
You can request a quote for Thiosulfuric acid, S-(2-(((3-hydroxytricyclo(3.3.1.1(sup 3,7))dec-1-yl)methyl)amino)-2-iminoethyl) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiosulfuric acid, S-(2-(((3-hydroxytricyclo(3.3.1.1(sup 3,7))dec-1-yl)methyl)amino)-2-iminoethyl) ester?
Yes, KEHONG BIO provides custom synthesis services for Thiosulfuric acid, S-(2-(((3-hydroxytricyclo(3.3.1.1(sup 3,7))dec-1-yl)methyl)amino)-2-iminoethyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.