Pyridine-2-azo-4-dimethylaniline cephalosporin
TL;DR: Pyridine-2-azo-4-dimethylaniline cephalosporin (CAS 77449-91-3) is a chemical compound with molecular formula C27H26N6O4S2 and molecular weight 562.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6R,7R)-3-[[2-[[4-(dimethylamino)phenyl]diazenyl]pyridin-1-ium-1-yl]methyl]-8-oxo-7-[(2-thiophen-2-ylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Also Known As: PADAC, Pyridine-2-azo-4-dimethylaniline cephalosporin, pyridine-2-azo-4-dimethylanilinecephalosporin, (6R,7R)-3-[[2-[[4-(dimethylamino)phenyl]diazenyl]pyridin-1-ium-1-yl]methyl]-8-oxo-7-[(2-thiophen-2-ylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate, (6R,7R)-3-[[2-(4-dimethylaminophenyl)diazenylpyridin-1-ium-1-yl]methyl]-8-oxo-7-[(2-thiophen-2-ylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
| Molecular Formula | C27H26N6O4S2 |
|---|---|
| Molecular Weight | 562.15 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 175.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 562.1457 |
| Heavy Atoms | 39 |
| Complexity | 993.0 |
Chemical Identifiers
| CAS Number | 77449-91-3 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)N=NC2=CC=CC=[N+]2CC3=C(N4[C@@H]([C@@H](C4=O)NC(=O)CC5=CC=CS5)SC3)C(=O)[O-] |
| InChIKey | FCHBECOAGZMTFE-ZEQKJWHPSA-N |
Product Overview
Pyridine-2-azo-4-dimethylaniline cephalosporin (CAS 77449-91-3), with molecular formula C27H26N6O4S2 and molecular weight 562.15 g/mol. IUPAC: (6R,7R)-3-[[2-[[4-(dimethylamino)phenyl]diazenyl]pyridin-1-ium-1-yl]methyl]-8-oxo-7-[(2-thiophen-2-ylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate.
Chemical Property Profile of Pyridine-2-azo-4-dimethylaniline cephalosporin
Property Insights of Pyridine-2-azo-4-dimethylaniline cephalosporin
The XLogP value of 4.1 indicates that Pyridine-2-azo-4-dimethylaniline cephalosporin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 175.0 Ų indicates high polarity, suggesting Pyridine-2-azo-4-dimethylaniline cephalosporin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Pyridine-2-azo-4-dimethylaniline cephalosporin has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pyridine-2-azo-4-dimethylaniline cephalosporin?
The CAS number of Pyridine-2-azo-4-dimethylaniline cephalosporin is 77449-91-3.
What is the molecular formula of Pyridine-2-azo-4-dimethylaniline cephalosporin?
The molecular formula of Pyridine-2-azo-4-dimethylaniline cephalosporin is C27H26N6O4S2.
What is the molecular weight of Pyridine-2-azo-4-dimethylaniline cephalosporin?
The molecular weight of Pyridine-2-azo-4-dimethylaniline cephalosporin is 562.15 g/mol.
Where can I buy Pyridine-2-azo-4-dimethylaniline cephalosporin?
You can request a quote for Pyridine-2-azo-4-dimethylaniline cephalosporin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridine-2-azo-4-dimethylaniline cephalosporin?
Yes, KEHONG BIO provides custom synthesis services for Pyridine-2-azo-4-dimethylaniline cephalosporin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.