3-((1,3-Dioxaindan-5-yl)sulfamoyl)benzoic acid
TL;DR: 3-((1,3-Dioxaindan-5-yl)sulfamoyl)benzoic acid (CAS 775310-75-3) is a chemical compound with molecular formula C14H11NO6S and molecular weight 321.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-benzodioxol-5-ylsulfamoyl)benzoic acid
Also Known As: 3-[(2H-1,3-benzodioxol-5-yl)sulfamoyl]benzoic acid, 3-[(1,3-dioxaindan-5-yl)sulfamoyl]benzoic acid, 3-(1,3-benzodioxol-5-ylsulfamoyl)benzoic acid, 3-[(1,3-benzodioxol-5-ylamino)sulfonyl]benzoic acid, 3-((1,3-Dioxaindan-5-yl)sulfamoyl)benzoic acid
| Molecular Formula | C14H11NO6S |
|---|---|
| Molecular Weight | 321.03 g/mol |
| LogP | 1.9143 |
| Topological Polar Surface Area | 101.93 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 321.0307 |
| Heavy Atoms | 22 |
| Complexity | 846.1616 |
Chemical Identifiers
| CAS Number | 775310-75-3 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)C(=O)O |
Product Overview
3-((1,3-Dioxaindan-5-yl)sulfamoyl)benzoic acid (CAS 775310-75-3), with molecular formula C14H11NO6S and molecular weight 321.03 g/mol. IUPAC: 3-(1,3-benzodioxol-5-ylsulfamoyl)benzoic acid.
Chemical Property Profile of 3-((1,3-Dioxaindan-5-yl)sulfamoyl)benzoic acid
Property Insights of 3-((1,3-Dioxaindan-5-yl)sulfamoyl)benzoic acid
The XLogP value of 1.9143 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-((1,3-Dioxaindan-5-yl)sulfamoyl)benzoic acid. The TPSA of 101.93 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((1,3-Dioxaindan-5-yl)sulfamoyl)benzoic acid. Following Lipinski's Rule of Five, 3-((1,3-Dioxaindan-5-yl)sulfamoyl)benzoic acid has 2 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 3-((1,3-Dioxaindan-5-yl)sulfamoyl)benzoic acid?
The CAS number of 3-((1,3-Dioxaindan-5-yl)sulfamoyl)benzoic acid is 775310-75-3.
What is the molecular formula of 3-((1,3-Dioxaindan-5-yl)sulfamoyl)benzoic acid?
The molecular formula of 3-((1,3-Dioxaindan-5-yl)sulfamoyl)benzoic acid is C14H11NO6S.
What is the molecular weight of 3-((1,3-Dioxaindan-5-yl)sulfamoyl)benzoic acid?
The molecular weight of 3-((1,3-Dioxaindan-5-yl)sulfamoyl)benzoic acid is 321.03 g/mol.
Where can I buy 3-((1,3-Dioxaindan-5-yl)sulfamoyl)benzoic acid?
You can request a quote for 3-((1,3-Dioxaindan-5-yl)sulfamoyl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((1,3-Dioxaindan-5-yl)sulfamoyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-((1,3-Dioxaindan-5-yl)sulfamoyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.