N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-2-iodobenzamide
TL;DR: N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-2-iodobenzamide (CAS 332389-94-3) is a chemical compound with molecular formula C15H14IN5O3S2 and molecular weight 502.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(diaminomethylideneamino)sulfonylphenyl]carbamothioyl]-2-iodobenzamide
Also Known As: BAS 01555709, N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-2-iodobenzamide, N-((4-(N-carbamimidoylsulfamoyl)phenyl)carbamothioyl)-2-iodobenzamide, N-[[4-(diaminomethylideneamino)sulfonylphenyl]carbamothioyl]-2-iodobenzamide
| Molecular Formula | C15H14IN5O3S2 |
|---|---|
| Molecular Weight | 502.96 g/mol |
| LogP | 1.3801 |
| Topological Polar Surface Area | 139.67 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 502.95828 |
| Heavy Atoms | 26 |
| Complexity | 971.0313 |
Chemical Identifiers
| CAS Number | 332389-94-3 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N=C(N)N)I |
Product Overview
N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-2-iodobenzamide (CAS 332389-94-3), with molecular formula C15H14IN5O3S2 and molecular weight 502.96 g/mol. IUPAC: N-[[4-(diaminomethylideneamino)sulfonylphenyl]carbamothioyl]-2-iodobenzamide.
Chemical Property Profile of N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-2-iodobenzamide
Property Insights of N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-2-iodobenzamide
The XLogP value of 1.3801 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-2-iodobenzamide. The TPSA of 139.67 Ų falls within the moderate polarity range, balancing permeability and solubility for N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-2-iodobenzamide. Following Lipinski's Rule of Five, N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-2-iodobenzamide has 4 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-2-iodobenzamide?
The CAS number of N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-2-iodobenzamide is 332389-94-3.
What is the molecular formula of N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-2-iodobenzamide?
The molecular formula of N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-2-iodobenzamide is C15H14IN5O3S2.
What is the molecular weight of N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-2-iodobenzamide?
The molecular weight of N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-2-iodobenzamide is 502.96 g/mol.
Where can I buy N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-2-iodobenzamide?
You can request a quote for N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-2-iodobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-2-iodobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-2-iodobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.