![Methyl 2-{[(4-azido-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate structure](/static/products/956/956624-40-1.png)
Methyl 2-{[(4-azido-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate
TL;DR: Methyl 2-{[(4-azido-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate (CAS 956624-40-1) is a chemical compound with molecular formula C13H12N8O5S and molecular weight 392.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(4-azido-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate
Also Known As: Methyl 2-[(4-azido-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate, methyl 2-(N-((4-azido-6-methyl-1,3,5-triazin-2-yl)carbamoyl)sulfamoyl)benzoate, methyl 2-{[(4-azido-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate
| Molecular Formula | C13H12N8O5S |
|---|---|
| Molecular Weight | 392.07 g/mol |
| LogP | 1.41882 |
| Topological Polar Surface Area | 189.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 392.06512 |
| Heavy Atoms | 27 |
| Complexity | 1048.4205 |
Chemical Identifiers
| CAS Number | 956624-40-1 |
|---|---|
| SMILES | CC1=NC(=NC(=N1)N=[N+]=[N-])NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC |
Product Overview
Methyl 2-{[(4-azido-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate (CAS 956624-40-1), with molecular formula C13H12N8O5S and molecular weight 392.07 g/mol. IUPAC: methyl 2-[(4-azido-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate.
Chemical Property Profile of Methyl 2-{[(4-azido-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate
Property Insights of Methyl 2-{[(4-azido-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate
The XLogP value of 1.41882 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-{[(4-azido-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate. The TPSA of 189.0 Ų indicates high polarity, suggesting Methyl 2-{[(4-azido-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Methyl 2-{[(4-azido-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate has 2 hydrogen bond donor(s) and 9 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 Methyl 2-{[(4-azido-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate?
The CAS number of Methyl 2-{[(4-azido-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate is 956624-40-1.
What is the molecular formula of Methyl 2-{[(4-azido-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate?
The molecular formula of Methyl 2-{[(4-azido-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate is C13H12N8O5S.
What is the molecular weight of Methyl 2-{[(4-azido-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate?
The molecular weight of Methyl 2-{[(4-azido-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate is 392.07 g/mol.
Where can I buy Methyl 2-{[(4-azido-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate?
You can request a quote for Methyl 2-{[(4-azido-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-{[(4-azido-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-{[(4-azido-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.