methyl N'-(4-fluorophenyl)carbamimidothioate;hydroiodide
TL;DR: methyl N'-(4-fluorophenyl)carbamimidothioate;hydroiodide (CAS 21722-13-4) is a chemical compound with molecular formula C8H10FIN2S and molecular weight 311.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N'-(4-fluorophenyl)carbamimidothioate;hydroiodide
Also Known As: 1-(4-fluoro-phenyl)-2-methyl-isothiourea hydroiodide, methyl N'-(4-fluorophenyl)carbamimidothioate hydroiodide, N-(4-fluorophenyl)(methylsulfanyl)methanimidamide hydroiodide, N'-(4-fluorophenyl)-1-methylsulfanyl-methanimidamide Hydroiodide
| Molecular Formula | C8H10FIN2S |
|---|---|
| Molecular Weight | 311.96 g/mol |
| LogP | 2.7529 |
| Topological Polar Surface Area | 38.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 311.95935 |
| Heavy Atoms | 13 |
| Complexity | 286.70044 |
Chemical Identifiers
| CAS Number | 21722-13-4 |
|---|---|
| SMILES | CSC(=NC1=CC=C(C=C1)F)N.I |
Product Overview
methyl N'-(4-fluorophenyl)carbamimidothioate;hydroiodide (CAS 21722-13-4), with molecular formula C8H10FIN2S and molecular weight 311.96 g/mol. IUPAC: methyl N'-(4-fluorophenyl)carbamimidothioate;hydroiodide.
Chemical Property Profile of methyl N'-(4-fluorophenyl)carbamimidothioate;hydroiodide
Property Insights of methyl N'-(4-fluorophenyl)carbamimidothioate;hydroiodide
The XLogP value of 2.7529 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N'-(4-fluorophenyl)carbamimidothioate;hydroiodide. With a topological polar surface area (TPSA) of 38.38 Ų, methyl N'-(4-fluorophenyl)carbamimidothioate;hydroiodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl N'-(4-fluorophenyl)carbamimidothioate;hydroiodide has 1 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 methyl N'-(4-fluorophenyl)carbamimidothioate;hydroiodide?
The CAS number of methyl N'-(4-fluorophenyl)carbamimidothioate;hydroiodide is 21722-13-4.
What is the molecular formula of methyl N'-(4-fluorophenyl)carbamimidothioate;hydroiodide?
The molecular formula of methyl N'-(4-fluorophenyl)carbamimidothioate;hydroiodide is C8H10FIN2S.
What is the molecular weight of methyl N'-(4-fluorophenyl)carbamimidothioate;hydroiodide?
The molecular weight of methyl N'-(4-fluorophenyl)carbamimidothioate;hydroiodide is 311.96 g/mol.
Where can I buy methyl N'-(4-fluorophenyl)carbamimidothioate;hydroiodide?
You can request a quote for methyl N'-(4-fluorophenyl)carbamimidothioate;hydroiodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N'-(4-fluorophenyl)carbamimidothioate;hydroiodide?
Yes, KEHONG BIO provides custom synthesis services for methyl N'-(4-fluorophenyl)carbamimidothioate;hydroiodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.