4-(dimethylaminodiazenyl)-1H-imidazole-5-carbonitrile
TL;DR: 4-(dimethylaminodiazenyl)-1H-imidazole-5-carbonitrile (CAS 57052-93-4) is a chemical compound with molecular formula C6H8N6 and molecular weight 164.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(dimethylaminodiazenyl)-1H-imidazole-5-carbonitrile
Also Known As: (5Z)-5-(dimethylaminohydrazinylidene)imidazole-4-carbonitril
| Molecular Formula | C6H8N6 |
|---|---|
| Molecular Weight | 164.08 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 80.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 164.08104 |
| Heavy Atoms | 12 |
| Complexity | 213.0 |
Chemical Identifiers
| CAS Number | 57052-93-4 |
|---|---|
| SMILES | CN(C)N=NC1=C(NC=N1)C#N |
| InChIKey | YIYVELWJQNDOTG-UHFFFAOYSA-N |
Product Overview
4-(dimethylaminodiazenyl)-1H-imidazole-5-carbonitrile (CAS 57052-93-4), with molecular formula C6H8N6 and molecular weight 164.08 g/mol. IUPAC: 4-(dimethylaminodiazenyl)-1H-imidazole-5-carbonitrile.
Chemical Property Profile of 4-(dimethylaminodiazenyl)-1H-imidazole-5-carbonitrile
Property Insights of 4-(dimethylaminodiazenyl)-1H-imidazole-5-carbonitrile
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(dimethylaminodiazenyl)-1H-imidazole-5-carbonitrile. The TPSA of 80.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(dimethylaminodiazenyl)-1H-imidazole-5-carbonitrile. Following Lipinski's Rule of Five, 4-(dimethylaminodiazenyl)-1H-imidazole-5-carbonitrile 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 4-(dimethylaminodiazenyl)-1H-imidazole-5-carbonitrile?
The CAS number of 4-(dimethylaminodiazenyl)-1H-imidazole-5-carbonitrile is 57052-93-4.
What is the molecular formula of 4-(dimethylaminodiazenyl)-1H-imidazole-5-carbonitrile?
The molecular formula of 4-(dimethylaminodiazenyl)-1H-imidazole-5-carbonitrile is C6H8N6.
What is the molecular weight of 4-(dimethylaminodiazenyl)-1H-imidazole-5-carbonitrile?
The molecular weight of 4-(dimethylaminodiazenyl)-1H-imidazole-5-carbonitrile is 164.08 g/mol.
Where can I buy 4-(dimethylaminodiazenyl)-1H-imidazole-5-carbonitrile?
You can request a quote for 4-(dimethylaminodiazenyl)-1H-imidazole-5-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(dimethylaminodiazenyl)-1H-imidazole-5-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-(dimethylaminodiazenyl)-1H-imidazole-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.