![2-Amino-3-[(2,3-dichlorobenzylidene)amino]-2-butenedinitrile structure](/static/products/4970/497060-70-5.webp)
2-Amino-3-[(2,3-dichlorobenzylidene)amino]-2-butenedinitrile
TL;DR: 2-Amino-3-[(2,3-dichlorobenzylidene)amino]-2-butenedinitrile (CAS 497060-70-5) is a chemical compound with molecular formula C11H6Cl2N4 and molecular weight 264.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-2-amino-3-[(2,3-dichlorophenyl)methylideneamino]but-2-enedinitrile
Also Known As: 2-amino-3-[(2,3-dichlorobenzylidene)amino]-2-butenedinitrile, AO-990/15068160, (Z)-2-amino-3-[(2,3-dichlorophenyl)methylideneamino]but-2-enedinitrile, 1-[(1E)-2-(2,3-dichlorophenyl)-1-azavinyl](1Z)-2-aminoethene-1,2-dicarbonitril e
| Molecular Formula | C11H6Cl2N4 |
|---|---|
| Molecular Weight | 264.00 g/mol |
| LogP | 2.62976 |
| Topological Polar Surface Area | 85.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 263.99695 |
| Heavy Atoms | 17 |
| Complexity | 576.11475 |
Chemical Identifiers
| CAS Number | 497060-70-5 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)Cl)C=N/C(=C(/C#N)\N)/C#N |
Product Overview
2-Amino-3-[(2,3-dichlorobenzylidene)amino]-2-butenedinitrile (CAS 497060-70-5), with molecular formula C11H6Cl2N4 and molecular weight 264.00 g/mol. IUPAC: (Z)-2-amino-3-[(2,3-dichlorophenyl)methylideneamino]but-2-enedinitrile.
Chemical Property Profile of 2-Amino-3-[(2,3-dichlorobenzylidene)amino]-2-butenedinitrile
Property Insights of 2-Amino-3-[(2,3-dichlorobenzylidene)amino]-2-butenedinitrile
The XLogP value of 2.62976 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Amino-3-[(2,3-dichlorobenzylidene)amino]-2-butenedinitrile. The TPSA of 85.96 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-3-[(2,3-dichlorobenzylidene)amino]-2-butenedinitrile. Following Lipinski's Rule of Five, 2-Amino-3-[(2,3-dichlorobenzylidene)amino]-2-butenedinitrile 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 2-Amino-3-[(2,3-dichlorobenzylidene)amino]-2-butenedinitrile?
The CAS number of 2-Amino-3-[(2,3-dichlorobenzylidene)amino]-2-butenedinitrile is 497060-70-5.
What is the molecular formula of 2-Amino-3-[(2,3-dichlorobenzylidene)amino]-2-butenedinitrile?
The molecular formula of 2-Amino-3-[(2,3-dichlorobenzylidene)amino]-2-butenedinitrile is C11H6Cl2N4.
What is the molecular weight of 2-Amino-3-[(2,3-dichlorobenzylidene)amino]-2-butenedinitrile?
The molecular weight of 2-Amino-3-[(2,3-dichlorobenzylidene)amino]-2-butenedinitrile is 264.00 g/mol.
Where can I buy 2-Amino-3-[(2,3-dichlorobenzylidene)amino]-2-butenedinitrile?
You can request a quote for 2-Amino-3-[(2,3-dichlorobenzylidene)amino]-2-butenedinitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-3-[(2,3-dichlorobenzylidene)amino]-2-butenedinitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-3-[(2,3-dichlorobenzylidene)amino]-2-butenedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.