S-2-amino-5-(dimethylammonio)phenyl sulfothioate
TL;DR: S-2-amino-5-(dimethylammonio)phenyl sulfothioate (CAS 43035-11-6) is a chemical compound with molecular formula C8H12N2O3S2 and molecular weight 248.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-amino-4-(dimethylamino)-2-sulfosulfanylbenzene
Also Known As: S-2-amino-5-(dimethylammonio)phenyl sulfothioate, Benzenethiol, 2-amino-5-(dimethylamino)-, sulfate, 2-amino-5-(dimethylamino)-benzenethiol sulfate, 2-amino-5-dimethylaminophenylthiosulphonic acid, [2-amino-5-(dimethylamino)phenyl]sulfanesulfonic acid
| Molecular Formula | C8H12N2O3S2 |
|---|---|
| Molecular Weight | 248.03 g/mol |
| LogP | 1.2297 |
| Topological Polar Surface Area | 83.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.02893 |
| Heavy Atoms | 15 |
| Complexity | 456.95462 |
Chemical Identifiers
| CAS Number | 43035-11-6 |
|---|---|
| SMILES | CN(C)C1=CC(=C(C=C1)N)SS(=O)(=O)O |
Product Overview
S-2-amino-5-(dimethylammonio)phenyl sulfothioate (CAS 43035-11-6), with molecular formula C8H12N2O3S2 and molecular weight 248.03 g/mol. IUPAC: 1-amino-4-(dimethylamino)-2-sulfosulfanylbenzene.
Chemical Property Profile of S-2-amino-5-(dimethylammonio)phenyl sulfothioate
Property Insights of S-2-amino-5-(dimethylammonio)phenyl sulfothioate
The XLogP value of 1.2297 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-2-amino-5-(dimethylammonio)phenyl sulfothioate. The TPSA of 83.63 Ų falls within the moderate polarity range, balancing permeability and solubility for S-2-amino-5-(dimethylammonio)phenyl sulfothioate. Following Lipinski's Rule of Five, S-2-amino-5-(dimethylammonio)phenyl sulfothioate has 2 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 S-2-amino-5-(dimethylammonio)phenyl sulfothioate?
The CAS number of S-2-amino-5-(dimethylammonio)phenyl sulfothioate is 43035-11-6.
What is the molecular formula of S-2-amino-5-(dimethylammonio)phenyl sulfothioate?
The molecular formula of S-2-amino-5-(dimethylammonio)phenyl sulfothioate is C8H12N2O3S2.
What is the molecular weight of S-2-amino-5-(dimethylammonio)phenyl sulfothioate?
The molecular weight of S-2-amino-5-(dimethylammonio)phenyl sulfothioate is 248.03 g/mol.
Where can I buy S-2-amino-5-(dimethylammonio)phenyl sulfothioate?
You can request a quote for S-2-amino-5-(dimethylammonio)phenyl sulfothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-2-amino-5-(dimethylammonio)phenyl sulfothioate?
Yes, KEHONG BIO provides custom synthesis services for S-2-amino-5-(dimethylammonio)phenyl sulfothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.