2-[(1E)-3,3-Dimethyltriaz-1-en-1-yl]-5-sulfamoylbenzamide
TL;DR: 2-[(1E)-3,3-Dimethyltriaz-1-en-1-yl]-5-sulfamoylbenzamide (CAS 66974-93-4) is a chemical compound with molecular formula C9H13N5O3S and molecular weight 271.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(dimethylaminodiazenyl)-5-sulfamoylbenzamide
Also Known As: Benzamide,3-dimethyl-1-triazenyl)-, 2-(dimethylaminodiazenyl)-5-sulfamoylbenzamide, 2-[(1E)-3,3-Dimethyltriaz-1-en-1-yl]-5-sulfamoylbenzamide, Benzamide, 5-(aminosulfonyl)-2-(3,3-dimethyl-1-triazenyl)-
| Molecular Formula | C9H13N5O3S |
|---|---|
| Molecular Weight | 271.07 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 140.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 271.0739 |
| Heavy Atoms | 18 |
| Complexity | 428.0 |
Chemical Identifiers
| CAS Number | 66974-93-4 |
|---|---|
| SMILES | CN(C)N=NC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)N |
| InChIKey | MCIBINQQGSWTBA-UHFFFAOYSA-N |
Product Overview
2-[(1E)-3,3-Dimethyltriaz-1-en-1-yl]-5-sulfamoylbenzamide (CAS 66974-93-4), with molecular formula C9H13N5O3S and molecular weight 271.07 g/mol. IUPAC: 2-(dimethylaminodiazenyl)-5-sulfamoylbenzamide.
Chemical Property Profile of 2-[(1E)-3,3-Dimethyltriaz-1-en-1-yl]-5-sulfamoylbenzamide
Property Insights of 2-[(1E)-3,3-Dimethyltriaz-1-en-1-yl]-5-sulfamoylbenzamide
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(1E)-3,3-Dimethyltriaz-1-en-1-yl]-5-sulfamoylbenzamide. The TPSA of 140.0 Ų indicates high polarity, suggesting 2-[(1E)-3,3-Dimethyltriaz-1-en-1-yl]-5-sulfamoylbenzamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-[(1E)-3,3-Dimethyltriaz-1-en-1-yl]-5-sulfamoylbenzamide has 2 hydrogen bond donor(s) and 7 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 2-[(1E)-3,3-Dimethyltriaz-1-en-1-yl]-5-sulfamoylbenzamide?
The CAS number of 2-[(1E)-3,3-Dimethyltriaz-1-en-1-yl]-5-sulfamoylbenzamide is 66974-93-4.
What is the molecular formula of 2-[(1E)-3,3-Dimethyltriaz-1-en-1-yl]-5-sulfamoylbenzamide?
The molecular formula of 2-[(1E)-3,3-Dimethyltriaz-1-en-1-yl]-5-sulfamoylbenzamide is C9H13N5O3S.
What is the molecular weight of 2-[(1E)-3,3-Dimethyltriaz-1-en-1-yl]-5-sulfamoylbenzamide?
The molecular weight of 2-[(1E)-3,3-Dimethyltriaz-1-en-1-yl]-5-sulfamoylbenzamide is 271.07 g/mol.
Where can I buy 2-[(1E)-3,3-Dimethyltriaz-1-en-1-yl]-5-sulfamoylbenzamide?
You can request a quote for 2-[(1E)-3,3-Dimethyltriaz-1-en-1-yl]-5-sulfamoylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(1E)-3,3-Dimethyltriaz-1-en-1-yl]-5-sulfamoylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[(1E)-3,3-Dimethyltriaz-1-en-1-yl]-5-sulfamoylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.