2-Acetamido-3-(3,4,5-trimethoxyphenyl)propanoic acid
TL;DR: 2-Acetamido-3-(3,4,5-trimethoxyphenyl)propanoic acid (CAS 18111-20-1) is a chemical compound with molecular formula C14H19NO6 and molecular weight 297.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-acetamido-3-(3,4,5-trimethoxyphenyl)propanoic acid
Also Known As: N-Acetyl-3,5-dimethoxy-O-methyltyrosine, 2-acetamido-3-(3,4,5-trimethoxyphenyl)propanoic acid
| Molecular Formula | C14H19NO6 |
|---|---|
| Molecular Weight | 297.12 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 94.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 297.12125 |
| Heavy Atoms | 21 |
| Complexity | 347.0 |
Chemical Identifiers
| CAS Number | 18111-20-1 |
|---|---|
| SMILES | CC(=O)NC(CC1=CC(=C(C(=C1)OC)OC)OC)C(=O)O |
| InChIKey | CLKLJJWOJMKFII-UHFFFAOYSA-N |
Product Overview
2-Acetamido-3-(3,4,5-trimethoxyphenyl)propanoic acid (CAS 18111-20-1), with molecular formula C14H19NO6 and molecular weight 297.12 g/mol. IUPAC: 2-acetamido-3-(3,4,5-trimethoxyphenyl)propanoic acid.
Chemical Property Profile of 2-Acetamido-3-(3,4,5-trimethoxyphenyl)propanoic acid
Property Insights of 2-Acetamido-3-(3,4,5-trimethoxyphenyl)propanoic acid
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Acetamido-3-(3,4,5-trimethoxyphenyl)propanoic acid. The TPSA of 94.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Acetamido-3-(3,4,5-trimethoxyphenyl)propanoic acid. Following Lipinski's Rule of Five, 2-Acetamido-3-(3,4,5-trimethoxyphenyl)propanoic acid has 2 hydrogen bond donor(s) and 6 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-Acetamido-3-(3,4,5-trimethoxyphenyl)propanoic acid?
The CAS number of 2-Acetamido-3-(3,4,5-trimethoxyphenyl)propanoic acid is 18111-20-1.
What is the molecular formula of 2-Acetamido-3-(3,4,5-trimethoxyphenyl)propanoic acid?
The molecular formula of 2-Acetamido-3-(3,4,5-trimethoxyphenyl)propanoic acid is C14H19NO6.
What is the molecular weight of 2-Acetamido-3-(3,4,5-trimethoxyphenyl)propanoic acid?
The molecular weight of 2-Acetamido-3-(3,4,5-trimethoxyphenyl)propanoic acid is 297.12 g/mol.
Where can I buy 2-Acetamido-3-(3,4,5-trimethoxyphenyl)propanoic acid?
You can request a quote for 2-Acetamido-3-(3,4,5-trimethoxyphenyl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Acetamido-3-(3,4,5-trimethoxyphenyl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Acetamido-3-(3,4,5-trimethoxyphenyl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.