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Methyl 2-{[2-(anilinocarbonyl)hydrazino]sulfonyl}benzenecarboxylate
TL;DR: Methyl 2-{[2-(anilinocarbonyl)hydrazino]sulfonyl}benzenecarboxylate (CAS 338399-85-2) is a chemical compound with molecular formula C15H15N3O5S and molecular weight 349.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(phenylcarbamoylamino)sulfamoyl]benzoate
Also Known As: methyl 2-[(phenylcarbamoylamino)sulfamoyl]benzoate, methyl 2-{[2-(anilinocarbonyl)hydrazino]sulfonyl}benzenecarboxylate, methyl 2-{[(phenylcarbamoyl)amino]sulfamoyl}benzoate, methyl2-{[(phenylcarbamoyl)amino]sulfamoyl}benzoate
| Molecular Formula | C15H15N3O5S |
|---|---|
| Molecular Weight | 349.07 g/mol |
| LogP | 1.4882 |
| Topological Polar Surface Area | 113.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 349.07324 |
| Heavy Atoms | 24 |
| Complexity | 837.1979 |
Chemical Identifiers
| CAS Number | 338399-85-2 |
|---|---|
| SMILES | COC(=O)C1=CC=CC=C1S(=O)(=O)NNC(=O)NC2=CC=CC=C2 |
Product Overview
Methyl 2-{[2-(anilinocarbonyl)hydrazino]sulfonyl}benzenecarboxylate (CAS 338399-85-2), with molecular formula C15H15N3O5S and molecular weight 349.07 g/mol. IUPAC: methyl 2-[(phenylcarbamoylamino)sulfamoyl]benzoate.
Chemical Property Profile of Methyl 2-{[2-(anilinocarbonyl)hydrazino]sulfonyl}benzenecarboxylate
Property Insights of Methyl 2-{[2-(anilinocarbonyl)hydrazino]sulfonyl}benzenecarboxylate
The XLogP value of 1.4882 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-{[2-(anilinocarbonyl)hydrazino]sulfonyl}benzenecarboxylate. The TPSA of 113.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-{[2-(anilinocarbonyl)hydrazino]sulfonyl}benzenecarboxylate. Following Lipinski's Rule of Five, Methyl 2-{[2-(anilinocarbonyl)hydrazino]sulfonyl}benzenecarboxylate has 3 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 Methyl 2-{[2-(anilinocarbonyl)hydrazino]sulfonyl}benzenecarboxylate?
The CAS number of Methyl 2-{[2-(anilinocarbonyl)hydrazino]sulfonyl}benzenecarboxylate is 338399-85-2.
What is the molecular formula of Methyl 2-{[2-(anilinocarbonyl)hydrazino]sulfonyl}benzenecarboxylate?
The molecular formula of Methyl 2-{[2-(anilinocarbonyl)hydrazino]sulfonyl}benzenecarboxylate is C15H15N3O5S.
What is the molecular weight of Methyl 2-{[2-(anilinocarbonyl)hydrazino]sulfonyl}benzenecarboxylate?
The molecular weight of Methyl 2-{[2-(anilinocarbonyl)hydrazino]sulfonyl}benzenecarboxylate is 349.07 g/mol.
Where can I buy Methyl 2-{[2-(anilinocarbonyl)hydrazino]sulfonyl}benzenecarboxylate?
You can request a quote for Methyl 2-{[2-(anilinocarbonyl)hydrazino]sulfonyl}benzenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-{[2-(anilinocarbonyl)hydrazino]sulfonyl}benzenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-{[2-(anilinocarbonyl)hydrazino]sulfonyl}benzenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.