4-Amino-5-(2-aminoanilino)phthalonitrile
TL;DR: 4-Amino-5-(2-aminoanilino)phthalonitrile (CAS 667432-67-9) is a chemical compound with molecular formula C14H11N5 and molecular weight 249.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-5-(2-aminoanilino)benzene-1,2-dicarbonitrile
Also Known As: 4-amino-5-(2-aminoanilino)phthalonitrile, 4-amino-5-(2-aminoanilino)benzene-1,2-dicarbonitrile, 4-amino-5-[(2-aminophenyl)amino]benzene-1,2-dicarbonitrile
| Molecular Formula | C14H11N5 |
|---|---|
| Molecular Weight | 249.10 g/mol |
| LogP | 2.33796 |
| Topological Polar Surface Area | 111.65 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 249.10144 |
| Heavy Atoms | 19 |
| Complexity | 706.7519 |
Chemical Identifiers
| CAS Number | 667432-67-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)N)NC2=C(C=C(C(=C2)C#N)C#N)N |
Product Overview
4-Amino-5-(2-aminoanilino)phthalonitrile (CAS 667432-67-9), with molecular formula C14H11N5 and molecular weight 249.10 g/mol. IUPAC: 4-amino-5-(2-aminoanilino)benzene-1,2-dicarbonitrile.
Chemical Property Profile of 4-Amino-5-(2-aminoanilino)phthalonitrile
Property Insights of 4-Amino-5-(2-aminoanilino)phthalonitrile
The XLogP value of 2.33796 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Amino-5-(2-aminoanilino)phthalonitrile. The TPSA of 111.65 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-5-(2-aminoanilino)phthalonitrile. Following Lipinski's Rule of Five, 4-Amino-5-(2-aminoanilino)phthalonitrile has 3 hydrogen bond donor(s) and 5 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-Amino-5-(2-aminoanilino)phthalonitrile?
The CAS number of 4-Amino-5-(2-aminoanilino)phthalonitrile is 667432-67-9.
What is the molecular formula of 4-Amino-5-(2-aminoanilino)phthalonitrile?
The molecular formula of 4-Amino-5-(2-aminoanilino)phthalonitrile is C14H11N5.
What is the molecular weight of 4-Amino-5-(2-aminoanilino)phthalonitrile?
The molecular weight of 4-Amino-5-(2-aminoanilino)phthalonitrile is 249.10 g/mol.
Where can I buy 4-Amino-5-(2-aminoanilino)phthalonitrile?
You can request a quote for 4-Amino-5-(2-aminoanilino)phthalonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amino-5-(2-aminoanilino)phthalonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-5-(2-aminoanilino)phthalonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.