![[2-(4-methoxyanilino)-2-oxoethyl] N-cyano-N'-(2-fluorophenyl)carbamimidothioate structure](/static/products/4881/488132-06-5.webp)
[2-(4-methoxyanilino)-2-oxoethyl] N-cyano-N'-(2-fluorophenyl)carbamimidothioate
TL;DR: [2-(4-methoxyanilino)-2-oxoethyl] N-cyano-N'-(2-fluorophenyl)carbamimidothioate (CAS 488132-06-5) is a chemical compound with molecular formula C17H15FN4O2S and molecular weight 358.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-methoxyanilino)-2-oxoethyl] N-cyano-N'-(2-fluorophenyl)carbamimidothioate
Also Known As: 2-{[(Z)-N'-cyano-N-(2-fluorophenyl)carbamimidoyl]sulfanyl}-N-(4-methoxyphenyl)acetamide, [2-(4-methoxyanilino)-2-oxoethyl] N-cyano-N'-(2-fluorophenyl)carbamimidothioate, (Z)-2-((4-methoxyphenyl)amino)-2-oxoethyl N'-cyano-N-(2-fluorophenyl)carbamimidothioate, 1-[((cyanoimino){[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl}methyl)amino]-2-fluorobenzene, 2-((4-methoxyphenyl)amino)-2-oxoethyl N'-cyano-N-(2-fluorophenyl)carbamimidothioate
| Molecular Formula | C17H15FN4O2S |
|---|---|
| Molecular Weight | 358.09 g/mol |
| LogP | 3.26438 |
| Topological Polar Surface Area | 86.51 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 358.08997 |
| Heavy Atoms | 25 |
| Complexity | 803.0403 |
Chemical Identifiers
| CAS Number | 488132-06-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(=O)CSC(=NC2=CC=CC=C2F)NC#N |
Product Overview
[2-(4-methoxyanilino)-2-oxoethyl] N-cyano-N'-(2-fluorophenyl)carbamimidothioate (CAS 488132-06-5), with molecular formula C17H15FN4O2S and molecular weight 358.09 g/mol. IUPAC: [2-(4-methoxyanilino)-2-oxoethyl] N-cyano-N'-(2-fluorophenyl)carbamimidothioate.
Chemical Property Profile of [2-(4-methoxyanilino)-2-oxoethyl] N-cyano-N'-(2-fluorophenyl)carbamimidothioate
Property Insights of [2-(4-methoxyanilino)-2-oxoethyl] N-cyano-N'-(2-fluorophenyl)carbamimidothioate
The XLogP value of 3.26438 indicates that [2-(4-methoxyanilino)-2-oxoethyl] N-cyano-N'-(2-fluorophenyl)carbamimidothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.51 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(4-methoxyanilino)-2-oxoethyl] N-cyano-N'-(2-fluorophenyl)carbamimidothioate. Following Lipinski's Rule of Five, [2-(4-methoxyanilino)-2-oxoethyl] N-cyano-N'-(2-fluorophenyl)carbamimidothioate 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 [2-(4-methoxyanilino)-2-oxoethyl] N-cyano-N'-(2-fluorophenyl)carbamimidothioate?
The CAS number of [2-(4-methoxyanilino)-2-oxoethyl] N-cyano-N'-(2-fluorophenyl)carbamimidothioate is 488132-06-5.
What is the molecular formula of [2-(4-methoxyanilino)-2-oxoethyl] N-cyano-N'-(2-fluorophenyl)carbamimidothioate?
The molecular formula of [2-(4-methoxyanilino)-2-oxoethyl] N-cyano-N'-(2-fluorophenyl)carbamimidothioate is C17H15FN4O2S.
What is the molecular weight of [2-(4-methoxyanilino)-2-oxoethyl] N-cyano-N'-(2-fluorophenyl)carbamimidothioate?
The molecular weight of [2-(4-methoxyanilino)-2-oxoethyl] N-cyano-N'-(2-fluorophenyl)carbamimidothioate is 358.09 g/mol.
Where can I buy [2-(4-methoxyanilino)-2-oxoethyl] N-cyano-N'-(2-fluorophenyl)carbamimidothioate?
You can request a quote for [2-(4-methoxyanilino)-2-oxoethyl] N-cyano-N'-(2-fluorophenyl)carbamimidothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(4-methoxyanilino)-2-oxoethyl] N-cyano-N'-(2-fluorophenyl)carbamimidothioate?
Yes, KEHONG BIO provides custom synthesis services for [2-(4-methoxyanilino)-2-oxoethyl] N-cyano-N'-(2-fluorophenyl)carbamimidothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.