4-((((Amino(imino)methyl)amino)(imino)methyl)amino)benzenesulfonamide
TL;DR: 4-((((Amino(imino)methyl)amino)(imino)methyl)amino)benzenesulfonamide (CAS 4751-94-4) is a chemical compound with molecular formula C8H12N6O2S and molecular weight 256.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(diaminomethylidene)-2-(4-sulfamoylphenyl)guanidine
Also Known As: NCIStruc1_001978, NCIStruc2_000695, Propanedinitrile,2-pyrrolidinylidene, 4-(3-carbamimidoylguanidino)benzenesulfonamide, NCI60_000589
| Molecular Formula | C8H12N6O2S |
|---|---|
| Molecular Weight | 256.07 g/mol |
| LogP | -1.5 |
| Topological Polar Surface Area | 171.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.07425 |
| Heavy Atoms | 17 |
| Complexity | 412.0 |
Chemical Identifiers
| CAS Number | 4751-94-4 |
|---|---|
| SMILES | C1=CC(=CC=C1N=C(N)N=C(N)N)S(=O)(=O)N |
| InChIKey | BRYMGHBYJDJPIS-UHFFFAOYSA-N |
Product Overview
4-((((Amino(imino)methyl)amino)(imino)methyl)amino)benzenesulfonamide (CAS 4751-94-4), with molecular formula C8H12N6O2S and molecular weight 256.07 g/mol. IUPAC: 1-(diaminomethylidene)-2-(4-sulfamoylphenyl)guanidine.
Chemical Property Profile of 4-((((Amino(imino)methyl)amino)(imino)methyl)amino)benzenesulfonamide
Property Insights of 4-((((Amino(imino)methyl)amino)(imino)methyl)amino)benzenesulfonamide
The XLogP value of -1.5 indicates that 4-((((Amino(imino)methyl)amino)(imino)methyl)amino)benzenesulfonamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 171.0 Ų indicates high polarity, suggesting 4-((((Amino(imino)methyl)amino)(imino)methyl)amino)benzenesulfonamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-((((Amino(imino)methyl)amino)(imino)methyl)amino)benzenesulfonamide has 4 hydrogen bond donor(s) and 4 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-((((Amino(imino)methyl)amino)(imino)methyl)amino)benzenesulfonamide?
The CAS number of 4-((((Amino(imino)methyl)amino)(imino)methyl)amino)benzenesulfonamide is 4751-94-4.
What is the molecular formula of 4-((((Amino(imino)methyl)amino)(imino)methyl)amino)benzenesulfonamide?
The molecular formula of 4-((((Amino(imino)methyl)amino)(imino)methyl)amino)benzenesulfonamide is C8H12N6O2S.
What is the molecular weight of 4-((((Amino(imino)methyl)amino)(imino)methyl)amino)benzenesulfonamide?
The molecular weight of 4-((((Amino(imino)methyl)amino)(imino)methyl)amino)benzenesulfonamide is 256.07 g/mol.
Where can I buy 4-((((Amino(imino)methyl)amino)(imino)methyl)amino)benzenesulfonamide?
You can request a quote for 4-((((Amino(imino)methyl)amino)(imino)methyl)amino)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((((Amino(imino)methyl)amino)(imino)methyl)amino)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-((((Amino(imino)methyl)amino)(imino)methyl)amino)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.