(2-Amino-1,3-thiazol-4-YL)methyl imidothiocarbamate dihydrochloride
TL;DR: (2-Amino-1,3-thiazol-4-YL)methyl imidothiocarbamate dihydrochloride (CAS 20167-22-0) is a chemical compound with molecular formula C5H10Cl2N4S2 and molecular weight 259.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-amino-1,3-thiazol-4-yl)methyl carbamimidothioate;dihydrochloride
Also Known As: AG 307, USAF A-1149, AGR 307, KST-1A2575, 2-((2-Amino-4-tiazolyl)methyl)isothiouronium dichloride
| Molecular Formula | C5H10Cl2N4S2 |
|---|---|
| Molecular Weight | 259.97 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 142.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 259.97238 |
| Heavy Atoms | 13 |
| Complexity | 151.0 |
Chemical Identifiers
| CAS Number | 20167-22-0 |
|---|---|
| SMILES | C1=C(N=C(S1)N)CSC(=N)N.Cl.Cl |
| InChIKey | WIXIDRZYQYPNGN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(2-Amino-1,3-thiazol-4-YL)methyl imidothiocarbamate dihydrochloride (CAS 20167-22-0), with molecular formula C5H10Cl2N4S2 and molecular weight 259.97 g/mol. IUPAC: (2-amino-1,3-thiazol-4-yl)methyl carbamimidothioate;dihydrochloride.
Chemical Property Profile of (2-Amino-1,3-thiazol-4-YL)methyl imidothiocarbamate dihydrochloride
Property Insights of (2-Amino-1,3-thiazol-4-YL)methyl imidothiocarbamate dihydrochloride
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Amino-1,3-thiazol-4-YL)methyl imidothiocarbamate dihydrochloride. The TPSA of 142.0 Ų indicates high polarity, suggesting (2-Amino-1,3-thiazol-4-YL)methyl imidothiocarbamate dihydrochloride may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (2-Amino-1,3-thiazol-4-YL)methyl imidothiocarbamate dihydrochloride has 5 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 (2-Amino-1,3-thiazol-4-YL)methyl imidothiocarbamate dihydrochloride?
The CAS number of (2-Amino-1,3-thiazol-4-YL)methyl imidothiocarbamate dihydrochloride is 20167-22-0.
What is the molecular formula of (2-Amino-1,3-thiazol-4-YL)methyl imidothiocarbamate dihydrochloride?
The molecular formula of (2-Amino-1,3-thiazol-4-YL)methyl imidothiocarbamate dihydrochloride is C5H10Cl2N4S2.
What is the molecular weight of (2-Amino-1,3-thiazol-4-YL)methyl imidothiocarbamate dihydrochloride?
The molecular weight of (2-Amino-1,3-thiazol-4-YL)methyl imidothiocarbamate dihydrochloride is 259.97 g/mol.
Where can I buy (2-Amino-1,3-thiazol-4-YL)methyl imidothiocarbamate dihydrochloride?
You can request a quote for (2-Amino-1,3-thiazol-4-YL)methyl imidothiocarbamate dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Amino-1,3-thiazol-4-YL)methyl imidothiocarbamate dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for (2-Amino-1,3-thiazol-4-YL)methyl imidothiocarbamate dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.