![methyl N'-[3,5-bis(trifluoromethyl)phenyl]carbamimidothioate structure](/static/products/6134/61343-64-4.webp)
methyl N'-[3,5-bis(trifluoromethyl)phenyl]carbamimidothioate
TL;DR: methyl N'-[3,5-bis(trifluoromethyl)phenyl]carbamimidothioate (CAS 61343-64-4) is a chemical compound with molecular formula C10H8F6N2S and molecular weight 302.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N'-[3,5-bis(trifluoromethyl)phenyl]carbamimidothioate
Also Known As: methyl N'-[3,5-bis(trifluoromethyl)phenyl]carbamimidothioate, Carbamimidothioic acid, [3,5-bis(trifluoromethyl)phenyl]-, methyl ester, N'-[3,5-bis(trifluoromethyl)phenyl]-1-methylsulfanyl-methanimidamide
| Molecular Formula | C10H8F6N2S |
|---|---|
| Molecular Weight | 302.03 g/mol |
| LogP | 4.0334 |
| Topological Polar Surface Area | 38.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 302.03125 |
| Heavy Atoms | 19 |
| Complexity | 459.52374 |
Chemical Identifiers
| CAS Number | 61343-64-4 |
|---|---|
| SMILES | CSC(=NC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)N |
Product Overview
methyl N'-[3,5-bis(trifluoromethyl)phenyl]carbamimidothioate (CAS 61343-64-4), with molecular formula C10H8F6N2S and molecular weight 302.03 g/mol. IUPAC: methyl N'-[3,5-bis(trifluoromethyl)phenyl]carbamimidothioate.
Chemical Property Profile of methyl N'-[3,5-bis(trifluoromethyl)phenyl]carbamimidothioate
Property Insights of methyl N'-[3,5-bis(trifluoromethyl)phenyl]carbamimidothioate
The XLogP value of 4.0334 indicates that methyl N'-[3,5-bis(trifluoromethyl)phenyl]carbamimidothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.38 Ų, methyl N'-[3,5-bis(trifluoromethyl)phenyl]carbamimidothioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl N'-[3,5-bis(trifluoromethyl)phenyl]carbamimidothioate 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'-[3,5-bis(trifluoromethyl)phenyl]carbamimidothioate?
The CAS number of methyl N'-[3,5-bis(trifluoromethyl)phenyl]carbamimidothioate is 61343-64-4.
What is the molecular formula of methyl N'-[3,5-bis(trifluoromethyl)phenyl]carbamimidothioate?
The molecular formula of methyl N'-[3,5-bis(trifluoromethyl)phenyl]carbamimidothioate is C10H8F6N2S.
What is the molecular weight of methyl N'-[3,5-bis(trifluoromethyl)phenyl]carbamimidothioate?
The molecular weight of methyl N'-[3,5-bis(trifluoromethyl)phenyl]carbamimidothioate is 302.03 g/mol.
Where can I buy methyl N'-[3,5-bis(trifluoromethyl)phenyl]carbamimidothioate?
You can request a quote for methyl N'-[3,5-bis(trifluoromethyl)phenyl]carbamimidothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N'-[3,5-bis(trifluoromethyl)phenyl]carbamimidothioate?
Yes, KEHONG BIO provides custom synthesis services for methyl N'-[3,5-bis(trifluoromethyl)phenyl]carbamimidothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.