N-((Phenylmethoxy)carbonyl)-L-phenylalanine ethyl ester
TL;DR: N-((Phenylmethoxy)carbonyl)-L-phenylalanine ethyl ester (CAS 28709-70-8) is a chemical compound with molecular formula C19H21NO4 and molecular weight 327.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoate
Also Known As: N-Carbobenzoxy-L-phenylalanine ethyl ester, N-benzyloxycarbonyl-D-phenylalanine, N-benzyloxycarbonyl-L-phenylalanine ethyl ester, L-N-Benzyloxycarbonyl-3-phenylalanine ethyl ester, ethyl (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoate
| Molecular Formula | C19H21NO4 |
|---|---|
| Molecular Weight | 327.15 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 64.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 327.14706 |
| Heavy Atoms | 24 |
| Complexity | 387.0 |
Chemical Identifiers
| CAS Number | 28709-70-8 |
|---|---|
| SMILES | CCOC(=O)[C@H](CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2 |
| InChIKey | XLLUIEKQXIOPDX-KRWDZBQOSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-((Phenylmethoxy)carbonyl)-L-phenylalanine ethyl ester (CAS 28709-70-8), with molecular formula C19H21NO4 and molecular weight 327.15 g/mol. IUPAC: ethyl (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoate.
Chemical Property Profile of N-((Phenylmethoxy)carbonyl)-L-phenylalanine ethyl ester
Property Insights of N-((Phenylmethoxy)carbonyl)-L-phenylalanine ethyl ester
The XLogP value of 3.7 indicates that N-((Phenylmethoxy)carbonyl)-L-phenylalanine ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N-((Phenylmethoxy)carbonyl)-L-phenylalanine ethyl ester. Following Lipinski's Rule of Five, N-((Phenylmethoxy)carbonyl)-L-phenylalanine ethyl ester 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 N-((Phenylmethoxy)carbonyl)-L-phenylalanine ethyl ester?
The CAS number of N-((Phenylmethoxy)carbonyl)-L-phenylalanine ethyl ester is 28709-70-8.
What is the molecular formula of N-((Phenylmethoxy)carbonyl)-L-phenylalanine ethyl ester?
The molecular formula of N-((Phenylmethoxy)carbonyl)-L-phenylalanine ethyl ester is C19H21NO4.
What is the molecular weight of N-((Phenylmethoxy)carbonyl)-L-phenylalanine ethyl ester?
The molecular weight of N-((Phenylmethoxy)carbonyl)-L-phenylalanine ethyl ester is 327.15 g/mol.
Where can I buy N-((Phenylmethoxy)carbonyl)-L-phenylalanine ethyl ester?
You can request a quote for N-((Phenylmethoxy)carbonyl)-L-phenylalanine ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-((Phenylmethoxy)carbonyl)-L-phenylalanine ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for N-((Phenylmethoxy)carbonyl)-L-phenylalanine ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.