4-((Pyridin-4-ylmethylene)amino)benzoic acid
TL;DR: 4-((Pyridin-4-ylmethylene)amino)benzoic acid (CAS 13160-75-3) is a chemical compound with molecular formula C13H10N2O2 and molecular weight 226.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(pyridin-4-ylmethylideneamino)benzoic acid
Also Known As: 4-(4-Pyridinylmethyleneamino)benzoic acid, 4-[(4-Pyridyl)methyleneamino]benzoic acid, 4-((Pyridin-4-ylmethylene)amino)benzoic acid, J3.262.516I, J3.282.814K
| Molecular Formula | C13H10N2O2 |
|---|---|
| Molecular Weight | 226.07 g/mol |
| LogP | 2.5304 |
| Topological Polar Surface Area | 62.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 226.07423 |
| Heavy Atoms | 17 |
| Complexity | 533.1057 |
Chemical Identifiers
| CAS Number | 13160-75-3 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)O)N=CC2=CC=NC=C2 |
Product Overview
4-((Pyridin-4-ylmethylene)amino)benzoic acid (CAS 13160-75-3), with molecular formula C13H10N2O2 and molecular weight 226.07 g/mol. IUPAC: 4-(pyridin-4-ylmethylideneamino)benzoic acid.
Chemical Property Profile of 4-((Pyridin-4-ylmethylene)amino)benzoic acid
Property Insights of 4-((Pyridin-4-ylmethylene)amino)benzoic acid
The XLogP value of 2.5304 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-((Pyridin-4-ylmethylene)amino)benzoic acid. The TPSA of 62.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-((Pyridin-4-ylmethylene)amino)benzoic acid. Following Lipinski's Rule of Five, 4-((Pyridin-4-ylmethylene)amino)benzoic acid has 1 hydrogen bond donor(s) and 3 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-((Pyridin-4-ylmethylene)amino)benzoic acid?
The CAS number of 4-((Pyridin-4-ylmethylene)amino)benzoic acid is 13160-75-3.
What is the molecular formula of 4-((Pyridin-4-ylmethylene)amino)benzoic acid?
The molecular formula of 4-((Pyridin-4-ylmethylene)amino)benzoic acid is C13H10N2O2.
What is the molecular weight of 4-((Pyridin-4-ylmethylene)amino)benzoic acid?
The molecular weight of 4-((Pyridin-4-ylmethylene)amino)benzoic acid is 226.07 g/mol.
Where can I buy 4-((Pyridin-4-ylmethylene)amino)benzoic acid?
You can request a quote for 4-((Pyridin-4-ylmethylene)amino)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((Pyridin-4-ylmethylene)amino)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-((Pyridin-4-ylmethylene)amino)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.