Methyl 2-amino-3-(4-phenylmethoxyphenyl)propanoate
TL;DR: Methyl 2-amino-3-(4-phenylmethoxyphenyl)propanoate (CAS 908066-33-1) is a chemical compound with molecular formula C17H19NO3 and molecular weight 285.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-amino-3-(4-phenylmethoxyphenyl)propanoate
Also Known As: Methyl O-benzyltyrosinate, O-(Phenylmethyl)tyrosine methyl ester, methyl 2-amino-3-(4-phenylmethoxyphenyl)propanoate, L-tyrosine,o-(phenylmethyl)-, methyl ester, J2.268.916I
| Molecular Formula | C17H19NO3 |
|---|---|
| Molecular Weight | 285.14 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 61.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 285.1365 |
| Heavy Atoms | 21 |
| Complexity | 307.0 |
Chemical Identifiers
| CAS Number | 908066-33-1 |
|---|---|
| SMILES | COC(=O)C(CC1=CC=C(C=C1)OCC2=CC=CC=C2)N |
| InChIKey | IUXVIPGPIFGSEU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 2-amino-3-(4-phenylmethoxyphenyl)propanoate (CAS 908066-33-1), with molecular formula C17H19NO3 and molecular weight 285.14 g/mol. IUPAC: methyl 2-amino-3-(4-phenylmethoxyphenyl)propanoate.
Chemical Property Profile of Methyl 2-amino-3-(4-phenylmethoxyphenyl)propanoate
Property Insights of Methyl 2-amino-3-(4-phenylmethoxyphenyl)propanoate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-amino-3-(4-phenylmethoxyphenyl)propanoate. The TPSA of 61.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-amino-3-(4-phenylmethoxyphenyl)propanoate. Following Lipinski's Rule of Five, Methyl 2-amino-3-(4-phenylmethoxyphenyl)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 Methyl 2-amino-3-(4-phenylmethoxyphenyl)propanoate?
The CAS number of Methyl 2-amino-3-(4-phenylmethoxyphenyl)propanoate is 908066-33-1.
What is the molecular formula of Methyl 2-amino-3-(4-phenylmethoxyphenyl)propanoate?
The molecular formula of Methyl 2-amino-3-(4-phenylmethoxyphenyl)propanoate is C17H19NO3.
What is the molecular weight of Methyl 2-amino-3-(4-phenylmethoxyphenyl)propanoate?
The molecular weight of Methyl 2-amino-3-(4-phenylmethoxyphenyl)propanoate is 285.14 g/mol.
Where can I buy Methyl 2-amino-3-(4-phenylmethoxyphenyl)propanoate?
You can request a quote for Methyl 2-amino-3-(4-phenylmethoxyphenyl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-amino-3-(4-phenylmethoxyphenyl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-amino-3-(4-phenylmethoxyphenyl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.