N-Acetyl-dl-phenylalanine p-nitrophenyl ester
TL;DR: N-Acetyl-dl-phenylalanine p-nitrophenyl ester (CAS 14009-94-0) is a chemical compound with molecular formula C17H16N2O5 and molecular weight 328.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-nitrophenyl) 2-acetamido-3-phenylpropanoate
Also Known As: N-Acetyl-dl-phenylalanine p-nitrophenyl ester, EINECS 254-131-5, Acetyl-DL-phenylalanine 4-nitrophenyl ester, (4-nitrophenyl) 2-acetamido-3-phenylpropanoate, 4-Nitrophenyl N-acetyl-3-phenyl-DL-alaninate
| Molecular Formula | C17H16N2O5 |
|---|---|
| Molecular Weight | 328.11 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 328.10593 |
| Heavy Atoms | 24 |
| Complexity | 448.0 |
Chemical Identifiers
| CAS Number | 14009-94-0 |
|---|---|
| SMILES | CC(=O)NC(CC1=CC=CC=C1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | OBFGGGOSBTXXCS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Acetyl-dl-phenylalanine p-nitrophenyl ester (CAS 14009-94-0), with molecular formula C17H16N2O5 and molecular weight 328.11 g/mol. IUPAC: (4-nitrophenyl) 2-acetamido-3-phenylpropanoate.
Chemical Property Profile of N-Acetyl-dl-phenylalanine p-nitrophenyl ester
Property Insights of N-Acetyl-dl-phenylalanine p-nitrophenyl ester
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Acetyl-dl-phenylalanine p-nitrophenyl ester. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Acetyl-dl-phenylalanine p-nitrophenyl ester. Following Lipinski's Rule of Five, N-Acetyl-dl-phenylalanine p-nitrophenyl ester has 1 hydrogen bond donor(s) and 5 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-Acetyl-dl-phenylalanine p-nitrophenyl ester?
The CAS number of N-Acetyl-dl-phenylalanine p-nitrophenyl ester is 14009-94-0.
What is the molecular formula of N-Acetyl-dl-phenylalanine p-nitrophenyl ester?
The molecular formula of N-Acetyl-dl-phenylalanine p-nitrophenyl ester is C17H16N2O5.
What is the molecular weight of N-Acetyl-dl-phenylalanine p-nitrophenyl ester?
The molecular weight of N-Acetyl-dl-phenylalanine p-nitrophenyl ester is 328.11 g/mol.
Where can I buy N-Acetyl-dl-phenylalanine p-nitrophenyl ester?
You can request a quote for N-Acetyl-dl-phenylalanine p-nitrophenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Acetyl-dl-phenylalanine p-nitrophenyl ester?
Yes, KEHONG BIO provides custom synthesis services for N-Acetyl-dl-phenylalanine p-nitrophenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.