Alpha-(4-cyanophenylimino)-O-cresol
TL;DR: Alpha-(4-cyanophenylimino)-O-cresol (CAS 654057-14-4) is a chemical compound with molecular formula C14H10N2O and molecular weight 222.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2-hydroxyphenyl)methylideneamino]benzonitrile
Also Known As: 4-{[(1E)-(2-hydroxyphenyl)methylene]amino}benzonitrile, 4-(Salicylideneamino)benzonitrile, 4-((2-Hydroxybenzylidene)amino)benzonitrile, 4-(2-Hydroxybenzylideneamino)benzonitrile, ALPHA-(4-CYANOPHENYLIMINO)-O-CRESOL
| Molecular Formula | C14H10N2O |
|---|---|
| Molecular Weight | 222.08 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 56.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 222.07932 |
| Heavy Atoms | 17 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 654057-14-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C=NC2=CC=C(C=C2)C#N)O |
| InChIKey | MCPDIZHVMWCVAM-UHFFFAOYSA-N |
Product Overview
Alpha-(4-cyanophenylimino)-O-cresol (CAS 654057-14-4), with molecular formula C14H10N2O and molecular weight 222.08 g/mol. IUPAC: 4-[(2-hydroxyphenyl)methylideneamino]benzonitrile.
Chemical Property Profile of Alpha-(4-cyanophenylimino)-O-cresol
Property Insights of Alpha-(4-cyanophenylimino)-O-cresol
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Alpha-(4-cyanophenylimino)-O-cresol. With a topological polar surface area (TPSA) of 56.4 Ų, Alpha-(4-cyanophenylimino)-O-cresol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Alpha-(4-cyanophenylimino)-O-cresol 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 Alpha-(4-cyanophenylimino)-O-cresol?
The CAS number of Alpha-(4-cyanophenylimino)-O-cresol is 654057-14-4.
What is the molecular formula of Alpha-(4-cyanophenylimino)-O-cresol?
The molecular formula of Alpha-(4-cyanophenylimino)-O-cresol is C14H10N2O.
What is the molecular weight of Alpha-(4-cyanophenylimino)-O-cresol?
The molecular weight of Alpha-(4-cyanophenylimino)-O-cresol is 222.08 g/mol.
Where can I buy Alpha-(4-cyanophenylimino)-O-cresol?
You can request a quote for Alpha-(4-cyanophenylimino)-O-cresol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alpha-(4-cyanophenylimino)-O-cresol?
Yes, KEHONG BIO provides custom synthesis services for Alpha-(4-cyanophenylimino)-O-cresol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.