![3-{[(1E)-(2-hydroxy-3-methoxyphenyl)methylene]amino}benzonitrile structure](/static/products/1193/1193753-02-4.webp)
3-{[(1E)-(2-hydroxy-3-methoxyphenyl)methylene]amino}benzonitrile
TL;DR: 3-{[(1E)-(2-hydroxy-3-methoxyphenyl)methylene]amino}benzonitrile (CAS 1193753-02-4) is a chemical compound with molecular formula C15H12N2O2 and molecular weight 252.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2-hydroxy-3-methoxyphenyl)methylideneamino]benzonitrile
Also Known As: 3-{[(1E)-(2-hydroxy-3-methoxyphenyl)methylene]amino}benzonitrile, (E)-3-((2-hydroxy-3-methoxybenzylidene)amino)benzonitrile, 3-[(2-hydroxy-3-methoxyphenyl)methylideneamino]benzonitrile, (E)-3-(2-Hydroxy-3-methoxybenzylideneamino)benzonitrile, 3-[(2-hydroxy-3-methoxy-phenyl)methyleneamino]benzonitrile
| Molecular Formula | C15H12N2O2 |
|---|---|
| Molecular Weight | 252.09 g/mol |
| LogP | 3.02308 |
| Topological Polar Surface Area | 65.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 252.08987 |
| Heavy Atoms | 19 |
| Complexity | 657.4354 |
Chemical Identifiers
| CAS Number | 1193753-02-4 |
|---|---|
| SMILES | COC1=CC=CC(=C1O)C=NC2=CC=CC(=C2)C#N |
Product Overview
3-{[(1E)-(2-hydroxy-3-methoxyphenyl)methylene]amino}benzonitrile (CAS 1193753-02-4), with molecular formula C15H12N2O2 and molecular weight 252.09 g/mol. IUPAC: 3-[(2-hydroxy-3-methoxyphenyl)methylideneamino]benzonitrile.
Chemical Property Profile of 3-{[(1E)-(2-hydroxy-3-methoxyphenyl)methylene]amino}benzonitrile
Property Insights of 3-{[(1E)-(2-hydroxy-3-methoxyphenyl)methylene]amino}benzonitrile
The XLogP value of 3.02308 indicates that 3-{[(1E)-(2-hydroxy-3-methoxyphenyl)methylene]amino}benzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.61 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{[(1E)-(2-hydroxy-3-methoxyphenyl)methylene]amino}benzonitrile. Following Lipinski's Rule of Five, 3-{[(1E)-(2-hydroxy-3-methoxyphenyl)methylene]amino}benzonitrile has 1 hydrogen bond donor(s) and 4 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 3-{[(1E)-(2-hydroxy-3-methoxyphenyl)methylene]amino}benzonitrile?
The CAS number of 3-{[(1E)-(2-hydroxy-3-methoxyphenyl)methylene]amino}benzonitrile is 1193753-02-4.
What is the molecular formula of 3-{[(1E)-(2-hydroxy-3-methoxyphenyl)methylene]amino}benzonitrile?
The molecular formula of 3-{[(1E)-(2-hydroxy-3-methoxyphenyl)methylene]amino}benzonitrile is C15H12N2O2.
What is the molecular weight of 3-{[(1E)-(2-hydroxy-3-methoxyphenyl)methylene]amino}benzonitrile?
The molecular weight of 3-{[(1E)-(2-hydroxy-3-methoxyphenyl)methylene]amino}benzonitrile is 252.09 g/mol.
Where can I buy 3-{[(1E)-(2-hydroxy-3-methoxyphenyl)methylene]amino}benzonitrile?
You can request a quote for 3-{[(1E)-(2-hydroxy-3-methoxyphenyl)methylene]amino}benzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{[(1E)-(2-hydroxy-3-methoxyphenyl)methylene]amino}benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-{[(1E)-(2-hydroxy-3-methoxyphenyl)methylene]amino}benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.