5-(1,3-Benzodioxol-5-ylsulfamoyl)-2-methoxybenzoic acid
TL;DR: 5-(1,3-Benzodioxol-5-ylsulfamoyl)-2-methoxybenzoic acid (CAS 433702-39-7) is a chemical compound with molecular formula C15H13NO7S and molecular weight 351.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(1,3-benzodioxol-5-ylsulfamoyl)-2-methoxybenzoic acid
Also Known As: Sulpiride impurity 19, 5-(1,3-benzodioxol-5-ylsulfamoyl)-2-methoxybenzoic acid, 5-(N-(benzo[d][1,3]dioxol-5-yl)sulfamoyl)-2-methoxybenzoic acid, 5-[(2H-benzo[3,4-d]1,3-dioxolen-5-ylamino)sulfonyl]-2-methoxybenzoic acid, Cambridge id 6945699
| Molecular Formula | C15H13NO7S |
|---|---|
| Molecular Weight | 351.04 g/mol |
| LogP | 1.9229 |
| Topological Polar Surface Area | 111.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 351.04126 |
| Heavy Atoms | 24 |
| Complexity | 908.03375 |
Chemical Identifiers
| CAS Number | 433702-39-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)OCO3)C(=O)O |
Product Overview
5-(1,3-Benzodioxol-5-ylsulfamoyl)-2-methoxybenzoic acid (CAS 433702-39-7), with molecular formula C15H13NO7S and molecular weight 351.04 g/mol. IUPAC: 5-(1,3-benzodioxol-5-ylsulfamoyl)-2-methoxybenzoic acid.
Chemical Property Profile of 5-(1,3-Benzodioxol-5-ylsulfamoyl)-2-methoxybenzoic acid
Property Insights of 5-(1,3-Benzodioxol-5-ylsulfamoyl)-2-methoxybenzoic acid
The XLogP value of 1.9229 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(1,3-Benzodioxol-5-ylsulfamoyl)-2-methoxybenzoic acid. The TPSA of 111.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(1,3-Benzodioxol-5-ylsulfamoyl)-2-methoxybenzoic acid. Following Lipinski's Rule of Five, 5-(1,3-Benzodioxol-5-ylsulfamoyl)-2-methoxybenzoic acid has 2 hydrogen bond donor(s) and 6 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 5-(1,3-Benzodioxol-5-ylsulfamoyl)-2-methoxybenzoic acid?
The CAS number of 5-(1,3-Benzodioxol-5-ylsulfamoyl)-2-methoxybenzoic acid is 433702-39-7.
What is the molecular formula of 5-(1,3-Benzodioxol-5-ylsulfamoyl)-2-methoxybenzoic acid?
The molecular formula of 5-(1,3-Benzodioxol-5-ylsulfamoyl)-2-methoxybenzoic acid is C15H13NO7S.
What is the molecular weight of 5-(1,3-Benzodioxol-5-ylsulfamoyl)-2-methoxybenzoic acid?
The molecular weight of 5-(1,3-Benzodioxol-5-ylsulfamoyl)-2-methoxybenzoic acid is 351.04 g/mol.
Where can I buy 5-(1,3-Benzodioxol-5-ylsulfamoyl)-2-methoxybenzoic acid?
You can request a quote for 5-(1,3-Benzodioxol-5-ylsulfamoyl)-2-methoxybenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(1,3-Benzodioxol-5-ylsulfamoyl)-2-methoxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-(1,3-Benzodioxol-5-ylsulfamoyl)-2-methoxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.