![5-Cyano-2-[(1E)-3,3-dimethyltriaz-1-en-1-yl]benzamide structure](/static/products/6697/66974-97-8.webp)
5-Cyano-2-[(1E)-3,3-dimethyltriaz-1-en-1-yl]benzamide
TL;DR: 5-Cyano-2-[(1E)-3,3-dimethyltriaz-1-en-1-yl]benzamide (CAS 66974-97-8) is a chemical compound with molecular formula C10H11N5O and molecular weight 217.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-cyano-2-(dimethylaminodiazenyl)benzamide
Also Known As: Benzamide,3-dimethyl-1-triazenyl)-, 5-cyano-2-(dimethylaminodiazenyl)benzamide, 5-Cyano-2-[(1E)-3,3-dimethyltriaz-1-en-1-yl]benzamide, Benzamide, 5-cyano-2-(3,3-dimethyl-1-triazenyl)-, Benzamide, 5-cyano-2-(3,3-dimethyl-1-triazen-1-yl)-
| Molecular Formula | C10H11N5O |
|---|---|
| Molecular Weight | 217.10 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 94.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 217.09636 |
| Heavy Atoms | 16 |
| Complexity | 329.0 |
Chemical Identifiers
| CAS Number | 66974-97-8 |
|---|---|
| SMILES | CN(C)N=NC1=C(C=C(C=C1)C#N)C(=O)N |
| InChIKey | RMRFZAZJEUUYOS-UHFFFAOYSA-N |
Product Overview
5-Cyano-2-[(1E)-3,3-dimethyltriaz-1-en-1-yl]benzamide (CAS 66974-97-8), with molecular formula C10H11N5O and molecular weight 217.10 g/mol. IUPAC: 5-cyano-2-(dimethylaminodiazenyl)benzamide.
Chemical Property Profile of 5-Cyano-2-[(1E)-3,3-dimethyltriaz-1-en-1-yl]benzamide
Property Insights of 5-Cyano-2-[(1E)-3,3-dimethyltriaz-1-en-1-yl]benzamide
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Cyano-2-[(1E)-3,3-dimethyltriaz-1-en-1-yl]benzamide. The TPSA of 94.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Cyano-2-[(1E)-3,3-dimethyltriaz-1-en-1-yl]benzamide. Following Lipinski's Rule of Five, 5-Cyano-2-[(1E)-3,3-dimethyltriaz-1-en-1-yl]benzamide 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
Frequently Asked Questions
What is the CAS number of 5-Cyano-2-[(1E)-3,3-dimethyltriaz-1-en-1-yl]benzamide?
The CAS number of 5-Cyano-2-[(1E)-3,3-dimethyltriaz-1-en-1-yl]benzamide is 66974-97-8.
What is the molecular formula of 5-Cyano-2-[(1E)-3,3-dimethyltriaz-1-en-1-yl]benzamide?
The molecular formula of 5-Cyano-2-[(1E)-3,3-dimethyltriaz-1-en-1-yl]benzamide is C10H11N5O.
What is the molecular weight of 5-Cyano-2-[(1E)-3,3-dimethyltriaz-1-en-1-yl]benzamide?
The molecular weight of 5-Cyano-2-[(1E)-3,3-dimethyltriaz-1-en-1-yl]benzamide is 217.10 g/mol.
Where can I buy 5-Cyano-2-[(1E)-3,3-dimethyltriaz-1-en-1-yl]benzamide?
You can request a quote for 5-Cyano-2-[(1E)-3,3-dimethyltriaz-1-en-1-yl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Cyano-2-[(1E)-3,3-dimethyltriaz-1-en-1-yl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 5-Cyano-2-[(1E)-3,3-dimethyltriaz-1-en-1-yl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.