![3-[(4,6-Dichloro-1,3,5-triazin-2-yl)amino]benzonitrile structure](/static/products/1468/146887-21-0.webp)
3-[(4,6-Dichloro-1,3,5-triazin-2-yl)amino]benzonitrile
TL;DR: 3-[(4,6-Dichloro-1,3,5-triazin-2-yl)amino]benzonitrile (CAS 146887-21-0) is a chemical compound with molecular formula C10H5Cl2N5 and molecular weight 264.9922 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]benzonitrile
Also Known As: 3-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]benzonitrile, 3-((4,6-Dichloro-1,3,5-triazin-2-yl)amino)benzonitrile, 3-[(dichloro-1,3,5-triazin-2-yl)amino]benzonitrile, Benzonitrile,3-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-, P-1,1-dimethylethyl-P-phenylphosphinoselenoic chloride
Technical Specifications
| Molecular Formula | C10H5Cl2N5 |
| Molecular Weight | 264.9922 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 74.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 264.9922 Da |
| Heavy Atoms | 17 |
| Complexity | 294.0 |
| SMILES | C1=CC(=CC(=C1)NC2=NC(=NC(=N2)Cl)Cl)C#N |
| InChIKey | AUFWCRWUKLWVCY-UHFFFAOYSA-N |
Chemical Property Profile of 3-[(4,6-Dichloro-1,3,5-triazin-2-yl)amino]benzonitrile
Property Insights of 3-[(4,6-Dichloro-1,3,5-triazin-2-yl)amino]benzonitrile
The XLogP value of 3.5 indicates that 3-[(4,6-Dichloro-1,3,5-triazin-2-yl)amino]benzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(4,6-Dichloro-1,3,5-triazin-2-yl)amino]benzonitrile. Following Lipinski's Rule of Five, 3-[(4,6-Dichloro-1,3,5-triazin-2-yl)amino]benzonitrile has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-[(4,6-Dichloro-1,3,5-triazin-2-yl)amino]benzonitrile?
The CAS number of 3-[(4,6-Dichloro-1,3,5-triazin-2-yl)amino]benzonitrile is 146887-21-0.
What is the molecular formula of 3-[(4,6-Dichloro-1,3,5-triazin-2-yl)amino]benzonitrile?
The molecular formula of 3-[(4,6-Dichloro-1,3,5-triazin-2-yl)amino]benzonitrile is C10H5Cl2N5.
What is the molecular weight of 3-[(4,6-Dichloro-1,3,5-triazin-2-yl)amino]benzonitrile?
The molecular weight of 3-[(4,6-Dichloro-1,3,5-triazin-2-yl)amino]benzonitrile is 264.9922 g/mol.
Where can I buy 3-[(4,6-Dichloro-1,3,5-triazin-2-yl)amino]benzonitrile?
You can request a quote for 3-[(4,6-Dichloro-1,3,5-triazin-2-yl)amino]benzonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-[(4,6-Dichloro-1,3,5-triazin-2-yl)amino]benzonitrile?
Yes, CoreyChem provides custom synthesis services for 3-[(4,6-Dichloro-1,3,5-triazin-2-yl)amino]benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.