N-(cyanomethyl)-2-(dimethylaminodiazenyl)benzamide
TL;DR: N-(cyanomethyl)-2-(dimethylaminodiazenyl)benzamide (CAS 66974-90-1) is a chemical compound with molecular formula C11H13N5O and molecular weight 231.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(cyanomethyl)-2-(dimethylaminodiazenyl)benzamide
Also Known As: N-(cyanomethyl)-2-(dimethylaminodiazenyl)benzamide, J1.586.178I, 2-(3,3-Dimethyl-1-triazenyl)-N-(cyanomethyl)benzamide, Benzamide, N-(cyanomethyl)-2-(3,3-dimethyl-1-triazen-1-yl)-, N-(CYANOMETHYL)-2-(3,3-DIMETHYLTRIAZ-1-EN-1-YL)BENZAMIDE
| Molecular Formula | C11H13N5O |
|---|---|
| Molecular Weight | 231.11 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 80.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 231.11201 |
| Heavy Atoms | 17 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 66974-90-1 |
|---|---|
| SMILES | CN(C)N=NC1=CC=CC=C1C(=O)NCC#N |
| InChIKey | NYXBBPKYDYESHK-UHFFFAOYSA-N |
Product Overview
N-(cyanomethyl)-2-(dimethylaminodiazenyl)benzamide (CAS 66974-90-1), with molecular formula C11H13N5O and molecular weight 231.11 g/mol. IUPAC: N-(cyanomethyl)-2-(dimethylaminodiazenyl)benzamide.
Chemical Property Profile of N-(cyanomethyl)-2-(dimethylaminodiazenyl)benzamide
Property Insights of N-(cyanomethyl)-2-(dimethylaminodiazenyl)benzamide
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(cyanomethyl)-2-(dimethylaminodiazenyl)benzamide. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(cyanomethyl)-2-(dimethylaminodiazenyl)benzamide. Following Lipinski's Rule of Five, N-(cyanomethyl)-2-(dimethylaminodiazenyl)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 N-(cyanomethyl)-2-(dimethylaminodiazenyl)benzamide?
The CAS number of N-(cyanomethyl)-2-(dimethylaminodiazenyl)benzamide is 66974-90-1.
What is the molecular formula of N-(cyanomethyl)-2-(dimethylaminodiazenyl)benzamide?
The molecular formula of N-(cyanomethyl)-2-(dimethylaminodiazenyl)benzamide is C11H13N5O.
What is the molecular weight of N-(cyanomethyl)-2-(dimethylaminodiazenyl)benzamide?
The molecular weight of N-(cyanomethyl)-2-(dimethylaminodiazenyl)benzamide is 231.11 g/mol.
Where can I buy N-(cyanomethyl)-2-(dimethylaminodiazenyl)benzamide?
You can request a quote for N-(cyanomethyl)-2-(dimethylaminodiazenyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(cyanomethyl)-2-(dimethylaminodiazenyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(cyanomethyl)-2-(dimethylaminodiazenyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.