2,2'-(Methanediyldiimino)dibenzonitrile
TL;DR: 2,2'-(Methanediyldiimino)dibenzonitrile (CAS 119403-97-3) is a chemical compound with molecular formula C15H12N4 and molecular weight 248.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-cyanoanilino)methylamino]benzonitrile
Also Known As: 2,2'-(methanediyldiimino)dibenzonitrile, 2-[(2-cyanoanilino)methylamino]benzonitrile, 2-({[(2-cyanophenyl)amino]methyl}amino)benzonitrile, 2-({[(2-cyanophenyl)amino]methyl}amino)benzenecarbonitrile
| Molecular Formula | C15H12N4 |
|---|---|
| Molecular Weight | 248.11 g/mol |
| LogP | 2.91146 |
| Topological Polar Surface Area | 71.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 248.1062 |
| Heavy Atoms | 19 |
| Complexity | 592.18054 |
Chemical Identifiers
| CAS Number | 119403-97-3 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C#N)NCNC2=CC=CC=C2C#N |
Product Overview
2,2'-(Methanediyldiimino)dibenzonitrile (CAS 119403-97-3), with molecular formula C15H12N4 and molecular weight 248.11 g/mol. IUPAC: 2-[(2-cyanoanilino)methylamino]benzonitrile.
Chemical Property Profile of 2,2'-(Methanediyldiimino)dibenzonitrile
Property Insights of 2,2'-(Methanediyldiimino)dibenzonitrile
The XLogP value of 2.91146 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2'-(Methanediyldiimino)dibenzonitrile. The TPSA of 71.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2'-(Methanediyldiimino)dibenzonitrile. Following Lipinski's Rule of Five, 2,2'-(Methanediyldiimino)dibenzonitrile has 2 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 2,2'-(Methanediyldiimino)dibenzonitrile?
The CAS number of 2,2'-(Methanediyldiimino)dibenzonitrile is 119403-97-3.
What is the molecular formula of 2,2'-(Methanediyldiimino)dibenzonitrile?
The molecular formula of 2,2'-(Methanediyldiimino)dibenzonitrile is C15H12N4.
What is the molecular weight of 2,2'-(Methanediyldiimino)dibenzonitrile?
The molecular weight of 2,2'-(Methanediyldiimino)dibenzonitrile is 248.11 g/mol.
Where can I buy 2,2'-(Methanediyldiimino)dibenzonitrile?
You can request a quote for 2,2'-(Methanediyldiimino)dibenzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2'-(Methanediyldiimino)dibenzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2,2'-(Methanediyldiimino)dibenzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.