4-(2-Amino-1-methylimidazo(4,5-b)pyrid-6-yl)phenyl sulfate
TL;DR: 4-(2-Amino-1-methylimidazo(4,5-b)pyrid-6-yl)phenyl sulfate (CAS 122664-96-4) is a chemical compound with molecular formula C13H12N4O4S and molecular weight 320.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(2-amino-1-methylimidazo[4,5-b]pyridin-6-yl)phenyl] hydrogen sulfate
Also Known As: 4-Phip sulfate, 4'-Hydroxy-PhIP-O-sulfate, [4-(2-amino-1-methylimidazo[4,5-b]pyridin-6-yl)phenyl] hydrogen sulfate, 4-(2-Amino-1-methylimidazo(4,5-b)pyrid-6-yl)phenyl sulfate, 1-Methyl-6-[4-(sulfooxy)phenyl]-1H-imidazo[4,5-b]pyridine-2-amine
| Molecular Formula | C13H12N4O4S |
|---|---|
| Molecular Weight | 320.06 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 320.05792 |
| Heavy Atoms | 22 |
| Complexity | 489.0 |
Chemical Identifiers
| CAS Number | 122664-96-4 |
|---|---|
| SMILES | CN1C2=C(N=CC(=C2)C3=CC=C(C=C3)OS(=O)(=O)O)N=C1N |
| InChIKey | SSEWDBILXMYUPG-UHFFFAOYSA-N |
Product Overview
4-(2-Amino-1-methylimidazo(4,5-b)pyrid-6-yl)phenyl sulfate (CAS 122664-96-4), with molecular formula C13H12N4O4S and molecular weight 320.06 g/mol. IUPAC: [4-(2-amino-1-methylimidazo[4,5-b]pyridin-6-yl)phenyl] hydrogen sulfate.
Chemical Property Profile of 4-(2-Amino-1-methylimidazo(4,5-b)pyrid-6-yl)phenyl sulfate
Property Insights of 4-(2-Amino-1-methylimidazo(4,5-b)pyrid-6-yl)phenyl sulfate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Amino-1-methylimidazo(4,5-b)pyrid-6-yl)phenyl sulfate. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-Amino-1-methylimidazo(4,5-b)pyrid-6-yl)phenyl sulfate. Following Lipinski's Rule of Five, 4-(2-Amino-1-methylimidazo(4,5-b)pyrid-6-yl)phenyl sulfate has 2 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 4-(2-Amino-1-methylimidazo(4,5-b)pyrid-6-yl)phenyl sulfate?
The CAS number of 4-(2-Amino-1-methylimidazo(4,5-b)pyrid-6-yl)phenyl sulfate is 122664-96-4.
What is the molecular formula of 4-(2-Amino-1-methylimidazo(4,5-b)pyrid-6-yl)phenyl sulfate?
The molecular formula of 4-(2-Amino-1-methylimidazo(4,5-b)pyrid-6-yl)phenyl sulfate is C13H12N4O4S.
What is the molecular weight of 4-(2-Amino-1-methylimidazo(4,5-b)pyrid-6-yl)phenyl sulfate?
The molecular weight of 4-(2-Amino-1-methylimidazo(4,5-b)pyrid-6-yl)phenyl sulfate is 320.06 g/mol.
Where can I buy 4-(2-Amino-1-methylimidazo(4,5-b)pyrid-6-yl)phenyl sulfate?
You can request a quote for 4-(2-Amino-1-methylimidazo(4,5-b)pyrid-6-yl)phenyl sulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Amino-1-methylimidazo(4,5-b)pyrid-6-yl)phenyl sulfate?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Amino-1-methylimidazo(4,5-b)pyrid-6-yl)phenyl sulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.