![2-(4-{[5-(4-Methoxyphenyl)-3-oxocyclohex-1-enyl]amino}phenyl)acetic acid structure](/static/products/5255/525581-64-0.webp)
2-(4-{[5-(4-Methoxyphenyl)-3-oxocyclohex-1-enyl]amino}phenyl)acetic acid
TL;DR: 2-(4-{[5-(4-Methoxyphenyl)-3-oxocyclohex-1-enyl]amino}phenyl)acetic acid (CAS 525581-64-0) is a chemical compound with molecular formula C21H21NO4 and molecular weight 351.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[[5-(4-methoxyphenyl)-3-oxocyclohexen-1-yl]amino]phenyl]acetic acid
Also Known As: 2-(4-{[5-(4-methoxyphenyl)-3-oxocyclohex-1-enyl]amino}phenyl)acetic acid, (4-{[5-(4-methoxyphenyl)-3-oxocyclohex-1-en-1-yl]amino}phenyl)acetic acid, 2-[4-[[5-(4-methoxyphenyl)-3-oxo-1-cyclohexenyl]amino]phenyl]acetic Acid, 2-[4-[[5-(4-methoxyphenyl)-3-oxocyclohexen-1-yl]amino]phenyl]acetic acid, 2-(4-{[5-(4-METHOXYPHENYL)-3-OXO-1-CYCLOHEXENYL]AMINO}PHENYL)ACETIC ACID
| Molecular Formula | C21H21NO4 |
|---|---|
| Molecular Weight | 351.15 g/mol |
| LogP | 3.7648 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 351.14706 |
| Heavy Atoms | 26 |
| Complexity | 822.0945 |
Chemical Identifiers
| CAS Number | 525581-64-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2CC(=CC(=O)C2)NC3=CC=C(C=C3)CC(=O)O |
Product Overview
2-(4-{[5-(4-Methoxyphenyl)-3-oxocyclohex-1-enyl]amino}phenyl)acetic acid (CAS 525581-64-0), with molecular formula C21H21NO4 and molecular weight 351.15 g/mol. IUPAC: 2-[4-[[5-(4-methoxyphenyl)-3-oxocyclohexen-1-yl]amino]phenyl]acetic acid.
Chemical Property Profile of 2-(4-{[5-(4-Methoxyphenyl)-3-oxocyclohex-1-enyl]amino}phenyl)acetic acid
Property Insights of 2-(4-{[5-(4-Methoxyphenyl)-3-oxocyclohex-1-enyl]amino}phenyl)acetic acid
The XLogP value of 3.7648 indicates that 2-(4-{[5-(4-Methoxyphenyl)-3-oxocyclohex-1-enyl]amino}phenyl)acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-{[5-(4-Methoxyphenyl)-3-oxocyclohex-1-enyl]amino}phenyl)acetic acid. Following Lipinski's Rule of Five, 2-(4-{[5-(4-Methoxyphenyl)-3-oxocyclohex-1-enyl]amino}phenyl)acetic acid has 2 hydrogen bond donor(s) and 4 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-{[5-(4-Methoxyphenyl)-3-oxocyclohex-1-enyl]amino}phenyl)acetic acid?
The CAS number of 2-(4-{[5-(4-Methoxyphenyl)-3-oxocyclohex-1-enyl]amino}phenyl)acetic acid is 525581-64-0.
What is the molecular formula of 2-(4-{[5-(4-Methoxyphenyl)-3-oxocyclohex-1-enyl]amino}phenyl)acetic acid?
The molecular formula of 2-(4-{[5-(4-Methoxyphenyl)-3-oxocyclohex-1-enyl]amino}phenyl)acetic acid is C21H21NO4.
What is the molecular weight of 2-(4-{[5-(4-Methoxyphenyl)-3-oxocyclohex-1-enyl]amino}phenyl)acetic acid?
The molecular weight of 2-(4-{[5-(4-Methoxyphenyl)-3-oxocyclohex-1-enyl]amino}phenyl)acetic acid is 351.15 g/mol.
Where can I buy 2-(4-{[5-(4-Methoxyphenyl)-3-oxocyclohex-1-enyl]amino}phenyl)acetic acid?
You can request a quote for 2-(4-{[5-(4-Methoxyphenyl)-3-oxocyclohex-1-enyl]amino}phenyl)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-(4-{[5-(4-Methoxyphenyl)-3-oxocyclohex-1-enyl]amino}phenyl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-{[5-(4-Methoxyphenyl)-3-oxocyclohex-1-enyl]amino}phenyl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.