![{2-Methoxy-6-[(5-oxo-2-thioxo-4-imidazolidinylidene)methyl]phenoxy}acetic acid structure](/static/products/6381/6381-11-9.webp)
{2-Methoxy-6-[(5-oxo-2-thioxo-4-imidazolidinylidene)methyl]phenoxy}acetic acid
TL;DR: {2-Methoxy-6-[(5-oxo-2-thioxo-4-imidazolidinylidene)methyl]phenoxy}acetic acid (CAS 6381-11-9) is a chemical compound with molecular formula C13H12N2O5S and molecular weight 308.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-methoxy-6-[(Z)-(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]phenoxy]acetic acid
Also Known As: AB00106598-01, AN-655/14023029, {2-methoxy-6-[(5-oxo-2-thioxo-4-imidazolidinylidene)methyl]phenoxy}acetic acid, 2-[2-methoxy-6-[(5-oxo-2-sulfanylidene-imidazolidin-4-ylidene)methyl]phenoxy]acetic Acid, 2-[2-methoxy-6-[(Z)-(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]phenoxy]acetic acid
| Molecular Formula | C13H12N2O5S |
|---|---|
| Molecular Weight | 308.05 g/mol |
| LogP | 0.5038 |
| Topological Polar Surface Area | 96.89 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 308.0467 |
| Heavy Atoms | 21 |
| Complexity | 641.44885 |
Chemical Identifiers
| CAS Number | 6381-11-9 |
|---|---|
| SMILES | COC1=CC=CC(=C1OCC(=O)O)/C=C\2/C(=O)NC(=S)N2 |
Product Overview
{2-Methoxy-6-[(5-oxo-2-thioxo-4-imidazolidinylidene)methyl]phenoxy}acetic acid (CAS 6381-11-9), with molecular formula C13H12N2O5S and molecular weight 308.05 g/mol. IUPAC: 2-[2-methoxy-6-[(Z)-(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]phenoxy]acetic acid.
Chemical Property Profile of {2-Methoxy-6-[(5-oxo-2-thioxo-4-imidazolidinylidene)methyl]phenoxy}acetic acid
Property Insights of {2-Methoxy-6-[(5-oxo-2-thioxo-4-imidazolidinylidene)methyl]phenoxy}acetic acid
The XLogP value of 0.5038 suggests moderate lipophilicity, balancing water solubility and membrane permeability for {2-Methoxy-6-[(5-oxo-2-thioxo-4-imidazolidinylidene)methyl]phenoxy}acetic acid. The TPSA of 96.89 Ų falls within the moderate polarity range, balancing permeability and solubility for {2-Methoxy-6-[(5-oxo-2-thioxo-4-imidazolidinylidene)methyl]phenoxy}acetic acid. Following Lipinski's Rule of Five, {2-Methoxy-6-[(5-oxo-2-thioxo-4-imidazolidinylidene)methyl]phenoxy}acetic acid has 3 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-Methoxy-6-[(5-oxo-2-thioxo-4-imidazolidinylidene)methyl]phenoxy}acetic acid?
The CAS number of {2-Methoxy-6-[(5-oxo-2-thioxo-4-imidazolidinylidene)methyl]phenoxy}acetic acid is 6381-11-9.
What is the molecular formula of {2-Methoxy-6-[(5-oxo-2-thioxo-4-imidazolidinylidene)methyl]phenoxy}acetic acid?
The molecular formula of {2-Methoxy-6-[(5-oxo-2-thioxo-4-imidazolidinylidene)methyl]phenoxy}acetic acid is C13H12N2O5S.
What is the molecular weight of {2-Methoxy-6-[(5-oxo-2-thioxo-4-imidazolidinylidene)methyl]phenoxy}acetic acid?
The molecular weight of {2-Methoxy-6-[(5-oxo-2-thioxo-4-imidazolidinylidene)methyl]phenoxy}acetic acid is 308.05 g/mol.
Where can I buy {2-Methoxy-6-[(5-oxo-2-thioxo-4-imidazolidinylidene)methyl]phenoxy}acetic acid?
You can request a quote for {2-Methoxy-6-[(5-oxo-2-thioxo-4-imidazolidinylidene)methyl]phenoxy}acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {2-Methoxy-6-[(5-oxo-2-thioxo-4-imidazolidinylidene)methyl]phenoxy}acetic acid?
Yes, KEHONG BIO provides custom synthesis services for {2-Methoxy-6-[(5-oxo-2-thioxo-4-imidazolidinylidene)methyl]phenoxy}acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.