benzyl (2S)-2-(methylamino)-3-phenylpropanoate
TL;DR: benzyl (2S)-2-(methylamino)-3-phenylpropanoate (CAS 47091-20-3) is a chemical compound with molecular formula C17H19NO2 and molecular weight 269.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl (2S)-2-(methylamino)-3-phenylpropanoate
Also Known As: N-Me-Phe-Obzl p-Tosylate, N-Methyl-L-phenylalanine phenylmethyl ester, Benzyl (2S)-2-methylamino-3-phenyl-propanoate, benzyl (2S)-2-(methylamino)-3-phenylpropanoate
| Molecular Formula | C17H19NO2 |
|---|---|
| Molecular Weight | 269.14 g/mol |
| LogP | 2.5605 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 269.14157 |
| Heavy Atoms | 20 |
| Complexity | 525.201 |
Chemical Identifiers
| CAS Number | 47091-20-3 |
|---|---|
| SMILES | CN[C@@H](CC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2 |
Product Overview
benzyl (2S)-2-(methylamino)-3-phenylpropanoate (CAS 47091-20-3), with molecular formula C17H19NO2 and molecular weight 269.14 g/mol. IUPAC: benzyl (2S)-2-(methylamino)-3-phenylpropanoate.
Chemical Property Profile of benzyl (2S)-2-(methylamino)-3-phenylpropanoate
Property Insights of benzyl (2S)-2-(methylamino)-3-phenylpropanoate
The XLogP value of 2.5605 suggests moderate lipophilicity, balancing water solubility and membrane permeability for benzyl (2S)-2-(methylamino)-3-phenylpropanoate. With a topological polar surface area (TPSA) of 38.33 Ų, benzyl (2S)-2-(methylamino)-3-phenylpropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, benzyl (2S)-2-(methylamino)-3-phenylpropanoate 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 benzyl (2S)-2-(methylamino)-3-phenylpropanoate?
The CAS number of benzyl (2S)-2-(methylamino)-3-phenylpropanoate is 47091-20-3.
What is the molecular formula of benzyl (2S)-2-(methylamino)-3-phenylpropanoate?
The molecular formula of benzyl (2S)-2-(methylamino)-3-phenylpropanoate is C17H19NO2.
What is the molecular weight of benzyl (2S)-2-(methylamino)-3-phenylpropanoate?
The molecular weight of benzyl (2S)-2-(methylamino)-3-phenylpropanoate is 269.14 g/mol.
Where can I buy benzyl (2S)-2-(methylamino)-3-phenylpropanoate?
You can request a quote for benzyl (2S)-2-(methylamino)-3-phenylpropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for benzyl (2S)-2-(methylamino)-3-phenylpropanoate?
Yes, KEHONG BIO provides custom synthesis services for benzyl (2S)-2-(methylamino)-3-phenylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.