2-Mercaptoacetamidine
TL;DR: 2-Mercaptoacetamidine (CAS 19412-52-3) is a chemical compound with molecular formula C2H7ClN2S and molecular weight 126.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-amino-2-sulfanylethylidene)azanium chloride
Also Known As: 2-Mercaptoacetamidine, 2-Mercaptoacetamidine hydrochloride, (1-amino-2-sulfanylethylidene)azanium;chloride, ACETAMIDINE, 2-MERCAPTO-, HYDROCHLORIDE, Acetamidine, 2-mercapto-, monohydrochloride
| Molecular Formula | C2H7ClN2S |
|---|---|
| Molecular Weight | 126.00 g/mol |
| LogP | -4.96 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 126.00185 |
| Heavy Atoms | 6 |
| Complexity | 37.0 |
Chemical Identifiers
| CAS Number | 19412-52-3 |
|---|---|
| SMILES | C(C(=[NH2+])N)S.[Cl-] |
| InChIKey | KUMNVTIEIZMRFS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Mercaptoacetamidine (CAS 19412-52-3), with molecular formula C2H7ClN2S and molecular weight 126.00 g/mol. IUPAC: (1-amino-2-sulfanylethylidene)azanium chloride.
Chemical Property Profile of 2-Mercaptoacetamidine
Property Insights of 2-Mercaptoacetamidine
The XLogP value of -4.96 indicates that 2-Mercaptoacetamidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 52.6 Ų, 2-Mercaptoacetamidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Mercaptoacetamidine has 3 hydrogen bond donor(s) and 2 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 2-Mercaptoacetamidine?
The CAS number of 2-Mercaptoacetamidine is 19412-52-3.
What is the molecular formula of 2-Mercaptoacetamidine?
The molecular formula of 2-Mercaptoacetamidine is C2H7ClN2S.
What is the molecular weight of 2-Mercaptoacetamidine?
The molecular weight of 2-Mercaptoacetamidine is 126.00 g/mol.
Where can I buy 2-Mercaptoacetamidine?
You can request a quote for 2-Mercaptoacetamidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Mercaptoacetamidine?
Yes, KEHONG BIO provides custom synthesis services for 2-Mercaptoacetamidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.