N-acetyl-4-nitrophenylalanine
TL;DR: N-acetyl-4-nitrophenylalanine (CAS 89615-73-6) is a chemical compound with molecular formula C11H12N2O5 and molecular weight 252.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-acetamido-3-(4-nitrophenyl)propanoic acid
Also Known As: N-acetyl-4-nitrophenylalanine, 2-acetamido-3-(4-nitrophenyl)propanoic acid, Phenylalanine, N-acetyl-4-nitro-, ZERO/006281, N-acetyl-4-nitro-DL-phenylalanine
| Molecular Formula | C11H12N2O5 |
|---|---|
| Molecular Weight | 252.07 g/mol |
| LogP | 0.7266 |
| Topological Polar Surface Area | 109.54 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 252.07462 |
| Heavy Atoms | 18 |
| Complexity | 468.82684 |
Chemical Identifiers
| CAS Number | 89615-73-6 |
|---|---|
| SMILES | CC(=O)NC(CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O |
Product Overview
N-acetyl-4-nitrophenylalanine (CAS 89615-73-6), with molecular formula C11H12N2O5 and molecular weight 252.07 g/mol. IUPAC: 2-acetamido-3-(4-nitrophenyl)propanoic acid.
Chemical Property Profile of N-acetyl-4-nitrophenylalanine
Property Insights of N-acetyl-4-nitrophenylalanine
The XLogP value of 0.7266 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-acetyl-4-nitrophenylalanine. The TPSA of 109.54 Ų falls within the moderate polarity range, balancing permeability and solubility for N-acetyl-4-nitrophenylalanine. Following Lipinski's Rule of Five, N-acetyl-4-nitrophenylalanine has 2 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-acetyl-4-nitrophenylalanine?
The CAS number of N-acetyl-4-nitrophenylalanine is 89615-73-6.
What is the molecular formula of N-acetyl-4-nitrophenylalanine?
The molecular formula of N-acetyl-4-nitrophenylalanine is C11H12N2O5.
What is the molecular weight of N-acetyl-4-nitrophenylalanine?
The molecular weight of N-acetyl-4-nitrophenylalanine is 252.07 g/mol.
Where can I buy N-acetyl-4-nitrophenylalanine?
You can request a quote for N-acetyl-4-nitrophenylalanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-acetyl-4-nitrophenylalanine?
Yes, KEHONG BIO provides custom synthesis services for N-acetyl-4-nitrophenylalanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.