4-((3-Methyl-4-phenyl-2(3H)-thiazolylidene)amino)benzeneacetic acid
TL;DR: 4-((3-Methyl-4-phenyl-2(3H)-thiazolylidene)amino)benzeneacetic acid (CAS 68194-87-6) is a chemical compound with molecular formula C18H16N2O2S and molecular weight 324.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[(3-methyl-4-phenyl-1,3-thiazol-2-ylidene)amino]phenyl]acetic acid
Also Known As: 4-((3-Methyl-4-phenyl-2(3H)-thiazolylidene)amino)benzeneacetic acid, Benzeneacetic acid, 4-((3-methyl-4-phenyl-2(3H)-thiazolylidene)amino)-, 2-[4-[(3-methyl-4-phenyl-1,3-thiazol-2-ylidene)amino]phenyl]acetic acid
| Molecular Formula | C18H16N2O2S |
|---|---|
| Molecular Weight | 324.09 g/mol |
| LogP | 3.6131 |
| Topological Polar Surface Area | 54.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 324.09326 |
| Heavy Atoms | 23 |
| Complexity | 877.39 |
Chemical Identifiers
| CAS Number | 68194-87-6 |
|---|---|
| SMILES | CN1C(=CSC1=NC2=CC=C(C=C2)CC(=O)O)C3=CC=CC=C3 |
Product Overview
4-((3-Methyl-4-phenyl-2(3H)-thiazolylidene)amino)benzeneacetic acid (CAS 68194-87-6), with molecular formula C18H16N2O2S and molecular weight 324.09 g/mol. IUPAC: 2-[4-[(3-methyl-4-phenyl-1,3-thiazol-2-ylidene)amino]phenyl]acetic acid.
Chemical Property Profile of 4-((3-Methyl-4-phenyl-2(3H)-thiazolylidene)amino)benzeneacetic acid
Property Insights of 4-((3-Methyl-4-phenyl-2(3H)-thiazolylidene)amino)benzeneacetic acid
The XLogP value of 3.6131 indicates that 4-((3-Methyl-4-phenyl-2(3H)-thiazolylidene)amino)benzeneacetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.59 Ų, 4-((3-Methyl-4-phenyl-2(3H)-thiazolylidene)amino)benzeneacetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-((3-Methyl-4-phenyl-2(3H)-thiazolylidene)amino)benzeneacetic acid has 1 hydrogen bond donor(s) and 3 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 4-((3-Methyl-4-phenyl-2(3H)-thiazolylidene)amino)benzeneacetic acid?
The CAS number of 4-((3-Methyl-4-phenyl-2(3H)-thiazolylidene)amino)benzeneacetic acid is 68194-87-6.
What is the molecular formula of 4-((3-Methyl-4-phenyl-2(3H)-thiazolylidene)amino)benzeneacetic acid?
The molecular formula of 4-((3-Methyl-4-phenyl-2(3H)-thiazolylidene)amino)benzeneacetic acid is C18H16N2O2S.
What is the molecular weight of 4-((3-Methyl-4-phenyl-2(3H)-thiazolylidene)amino)benzeneacetic acid?
The molecular weight of 4-((3-Methyl-4-phenyl-2(3H)-thiazolylidene)amino)benzeneacetic acid is 324.09 g/mol.
Where can I buy 4-((3-Methyl-4-phenyl-2(3H)-thiazolylidene)amino)benzeneacetic acid?
You can request a quote for 4-((3-Methyl-4-phenyl-2(3H)-thiazolylidene)amino)benzeneacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((3-Methyl-4-phenyl-2(3H)-thiazolylidene)amino)benzeneacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-((3-Methyl-4-phenyl-2(3H)-thiazolylidene)amino)benzeneacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.