Phenethyl 2-amino-3-(4-methoxyphenyl)propanoate
TL;DR: Phenethyl 2-amino-3-(4-methoxyphenyl)propanoate (CAS 6330-22-9) is a chemical compound with molecular formula C18H21NO3 and molecular weight 299.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenylethyl 2-amino-3-(4-methoxyphenyl)propanoate
Also Known As: 2-Phenylethyl O-methyltyrosinate, phenethyl 2-amino-3-(4-methoxyphenyl)propanoate, 2-phenylethyl 2-amino-3-(4-methoxyphenyl)propanoate
| Molecular Formula | C18H21NO3 |
|---|---|
| Molecular Weight | 299.15 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 61.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 299.15213 |
| Heavy Atoms | 22 |
| Complexity | 320.0 |
Chemical Identifiers
| CAS Number | 6330-22-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CC(C(=O)OCCC2=CC=CC=C2)N |
| InChIKey | LQAKRDXSVHMAMG-UHFFFAOYSA-N |
Product Overview
Phenethyl 2-amino-3-(4-methoxyphenyl)propanoate (CAS 6330-22-9), with molecular formula C18H21NO3 and molecular weight 299.15 g/mol. IUPAC: 2-phenylethyl 2-amino-3-(4-methoxyphenyl)propanoate.
Chemical Property Profile of Phenethyl 2-amino-3-(4-methoxyphenyl)propanoate
Property Insights of Phenethyl 2-amino-3-(4-methoxyphenyl)propanoate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenethyl 2-amino-3-(4-methoxyphenyl)propanoate. The TPSA of 61.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenethyl 2-amino-3-(4-methoxyphenyl)propanoate. Following Lipinski's Rule of Five, Phenethyl 2-amino-3-(4-methoxyphenyl)propanoate has 1 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 Phenethyl 2-amino-3-(4-methoxyphenyl)propanoate?
The CAS number of Phenethyl 2-amino-3-(4-methoxyphenyl)propanoate is 6330-22-9.
What is the molecular formula of Phenethyl 2-amino-3-(4-methoxyphenyl)propanoate?
The molecular formula of Phenethyl 2-amino-3-(4-methoxyphenyl)propanoate is C18H21NO3.
What is the molecular weight of Phenethyl 2-amino-3-(4-methoxyphenyl)propanoate?
The molecular weight of Phenethyl 2-amino-3-(4-methoxyphenyl)propanoate is 299.15 g/mol.
Where can I buy Phenethyl 2-amino-3-(4-methoxyphenyl)propanoate?
You can request a quote for Phenethyl 2-amino-3-(4-methoxyphenyl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenethyl 2-amino-3-(4-methoxyphenyl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Phenethyl 2-amino-3-(4-methoxyphenyl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.