1-(2-Hydroxy-3-(4-(4-nitrobenzoyl)phenoxy)propyl)-4-phenylpyridinium chloride
TL;DR: 1-(2-Hydroxy-3-(4-(4-nitrobenzoyl)phenoxy)propyl)-4-phenylpyridinium chloride (CAS 108357-17-1) is a chemical compound with molecular formula C27H23ClN2O5 and molecular weight 490.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[2-hydroxy-3-(4-phenylpyridin-1-ium-1-yl)propoxy]phenyl]-(4-nitrophenyl)methanone chloride
Also Known As: 1-(2-Hydroxy-3-(4-(4-nitrobenzoyl)phenoxy)propyl)-4-phenylpyridinium chloride, 1-(2-Hydroxy-3-(p-(p-nitrobenzoyl)phenoxy)propyl)-4-phenylpyridinium chloride, Pyridinium, 1-(2-hydroxy-3-(4-(4-nitrobenzoyl)phenoxy)propyl)-4-phenyl-, chloride, Pyridinium,1-[2-hydroxy-3-[4-(4-nitrobenzoyl)phenoxy]propyl]-4-phenyl-, chloride (1:1), 1-[2-hydroxy-3-[p-(p-nitrobenzoyl)phenoxy]propyl]-4-phenylpyridinium chloride
| Molecular Formula | C27H23ClN2O5 |
|---|---|
| Molecular Weight | 490.13 g/mol |
| LogP | 1.2242 |
| Topological Polar Surface Area | 93.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 490.12955 |
| Heavy Atoms | 35 |
| Complexity | 1261.9833 |
Chemical Identifiers
| CAS Number | 108357-17-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=[N+](C=C2)CC(COC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-])O.[Cl-] |
Product Overview
1-(2-Hydroxy-3-(4-(4-nitrobenzoyl)phenoxy)propyl)-4-phenylpyridinium chloride (CAS 108357-17-1), with molecular formula C27H23ClN2O5 and molecular weight 490.13 g/mol. IUPAC: [4-[2-hydroxy-3-(4-phenylpyridin-1-ium-1-yl)propoxy]phenyl]-(4-nitrophenyl)methanone chloride.
Chemical Property Profile of 1-(2-Hydroxy-3-(4-(4-nitrobenzoyl)phenoxy)propyl)-4-phenylpyridinium chloride
Property Insights of 1-(2-Hydroxy-3-(4-(4-nitrobenzoyl)phenoxy)propyl)-4-phenylpyridinium chloride
The XLogP value of 1.2242 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Hydroxy-3-(4-(4-nitrobenzoyl)phenoxy)propyl)-4-phenylpyridinium chloride. The TPSA of 93.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Hydroxy-3-(4-(4-nitrobenzoyl)phenoxy)propyl)-4-phenylpyridinium chloride. Following Lipinski's Rule of Five, 1-(2-Hydroxy-3-(4-(4-nitrobenzoyl)phenoxy)propyl)-4-phenylpyridinium chloride 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 1-(2-Hydroxy-3-(4-(4-nitrobenzoyl)phenoxy)propyl)-4-phenylpyridinium chloride?
The CAS number of 1-(2-Hydroxy-3-(4-(4-nitrobenzoyl)phenoxy)propyl)-4-phenylpyridinium chloride is 108357-17-1.
What is the molecular formula of 1-(2-Hydroxy-3-(4-(4-nitrobenzoyl)phenoxy)propyl)-4-phenylpyridinium chloride?
The molecular formula of 1-(2-Hydroxy-3-(4-(4-nitrobenzoyl)phenoxy)propyl)-4-phenylpyridinium chloride is C27H23ClN2O5.
What is the molecular weight of 1-(2-Hydroxy-3-(4-(4-nitrobenzoyl)phenoxy)propyl)-4-phenylpyridinium chloride?
The molecular weight of 1-(2-Hydroxy-3-(4-(4-nitrobenzoyl)phenoxy)propyl)-4-phenylpyridinium chloride is 490.13 g/mol.
Where can I buy 1-(2-Hydroxy-3-(4-(4-nitrobenzoyl)phenoxy)propyl)-4-phenylpyridinium chloride?
You can request a quote for 1-(2-Hydroxy-3-(4-(4-nitrobenzoyl)phenoxy)propyl)-4-phenylpyridinium chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Hydroxy-3-(4-(4-nitrobenzoyl)phenoxy)propyl)-4-phenylpyridinium chloride?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Hydroxy-3-(4-(4-nitrobenzoyl)phenoxy)propyl)-4-phenylpyridinium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.