Phenylalanine, 4-((3-nitro-9-acridinyl)amino)-, monohydrochloride
TL;DR: Phenylalanine, 4-((3-nitro-9-acridinyl)amino)-, monohydrochloride (CAS 64895-16-5) is a chemical compound with molecular formula C22H19ClN4O4 and molecular weight 438.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-amino-3-[4-[(3-nitroacridin-9-yl)amino]phenyl]propanoic acid;hydrochloride
Also Known As: Phenylalanine, 4-((3-nitro-9-acridinyl)amino)-, monohydrochloride, (2S)-2-amino-3-[4-[(3-nitroacridin-9-yl)amino]phenyl]propanoic acid hydrochloride, 4-[(3-Nitroacridin-9(10H)-ylidene)amino]-L-phenylalanine--hydrogen chloride (1/1), 4-[(3-Nitroacridin-9(10H)-ylidene)amino]phenylalanine--hydrogen chloride (1/1)
| Molecular Formula | C22H19ClN4O4 |
|---|---|
| Molecular Weight | 438.11 g/mol |
| LogP | 4.416 |
| Topological Polar Surface Area | 134.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 438.1095 |
| Heavy Atoms | 31 |
| Complexity | 619.0 |
Chemical Identifiers
| CAS Number | 64895-16-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C3C=CC(=CC3=N2)[N+](=O)[O-])NC4=CC=C(C=C4)C[C@@H](C(=O)O)N.Cl |
| InChIKey | QOYWFIBYAGFQHX-FERBBOLQSA-N |
Product Overview
Phenylalanine, 4-((3-nitro-9-acridinyl)amino)-, monohydrochloride (CAS 64895-16-5), with molecular formula C22H19ClN4O4 and molecular weight 438.11 g/mol. IUPAC: (2S)-2-amino-3-[4-[(3-nitroacridin-9-yl)amino]phenyl]propanoic acid;hydrochloride.
Chemical Property Profile of Phenylalanine, 4-((3-nitro-9-acridinyl)amino)-, monohydrochloride
Property Insights of Phenylalanine, 4-((3-nitro-9-acridinyl)amino)-, monohydrochloride
The XLogP value of 4.416 indicates that Phenylalanine, 4-((3-nitro-9-acridinyl)amino)-, monohydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenylalanine, 4-((3-nitro-9-acridinyl)amino)-, monohydrochloride. Following Lipinski's Rule of Five, Phenylalanine, 4-((3-nitro-9-acridinyl)amino)-, monohydrochloride has 4 hydrogen bond donor(s) and 7 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 Phenylalanine, 4-((3-nitro-9-acridinyl)amino)-, monohydrochloride?
The CAS number of Phenylalanine, 4-((3-nitro-9-acridinyl)amino)-, monohydrochloride is 64895-16-5.
What is the molecular formula of Phenylalanine, 4-((3-nitro-9-acridinyl)amino)-, monohydrochloride?
The molecular formula of Phenylalanine, 4-((3-nitro-9-acridinyl)amino)-, monohydrochloride is C22H19ClN4O4.
What is the molecular weight of Phenylalanine, 4-((3-nitro-9-acridinyl)amino)-, monohydrochloride?
The molecular weight of Phenylalanine, 4-((3-nitro-9-acridinyl)amino)-, monohydrochloride is 438.11 g/mol.
Where can I buy Phenylalanine, 4-((3-nitro-9-acridinyl)amino)-, monohydrochloride?
You can request a quote for Phenylalanine, 4-((3-nitro-9-acridinyl)amino)-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenylalanine, 4-((3-nitro-9-acridinyl)amino)-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Phenylalanine, 4-((3-nitro-9-acridinyl)amino)-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.