2-Bromo-5-[(prop-2-en-1-yl)sulfamoyl]benzoic acid
TL;DR: 2-Bromo-5-[(prop-2-en-1-yl)sulfamoyl]benzoic acid (CAS 790271-07-7) is a chemical compound with molecular formula C10H10BrNO4S and molecular weight 318.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-5-(prop-2-enylsulfamoyl)benzoic acid
Also Known As: 2-bromo-5-[(prop-2-en-1-yl)sulfamoyl]benzoic acid, 5-[(allylamino)sulfonyl]-2-bromobenzoic acid, 2-bromo-5-(prop-2-enylsulfamoyl)benzoic Acid, 5-(allylsulfamoyl)-2-bromo-benzoic acid, 2-bromo-5-[(prop-2-en-1-yl)sulfamoyl]benzoicacid
| Molecular Formula | C10H10BrNO4S |
|---|---|
| Molecular Weight | 318.95 g/mol |
| LogP | 1.6116 |
| Topological Polar Surface Area | 83.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 318.9514 |
| Heavy Atoms | 17 |
| Complexity | 553.4244 |
Chemical Identifiers
| CAS Number | 790271-07-7 |
|---|---|
| SMILES | C=CCNS(=O)(=O)C1=CC(=C(C=C1)Br)C(=O)O |
Product Overview
2-Bromo-5-[(prop-2-en-1-yl)sulfamoyl]benzoic acid (CAS 790271-07-7), with molecular formula C10H10BrNO4S and molecular weight 318.95 g/mol. IUPAC: 2-bromo-5-(prop-2-enylsulfamoyl)benzoic acid.
Chemical Property Profile of 2-Bromo-5-[(prop-2-en-1-yl)sulfamoyl]benzoic acid
Property Insights of 2-Bromo-5-[(prop-2-en-1-yl)sulfamoyl]benzoic acid
The XLogP value of 1.6116 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromo-5-[(prop-2-en-1-yl)sulfamoyl]benzoic acid. The TPSA of 83.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Bromo-5-[(prop-2-en-1-yl)sulfamoyl]benzoic acid. Following Lipinski's Rule of Five, 2-Bromo-5-[(prop-2-en-1-yl)sulfamoyl]benzoic acid has 2 hydrogen bond donor(s) and 3 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 2-Bromo-5-[(prop-2-en-1-yl)sulfamoyl]benzoic acid?
The CAS number of 2-Bromo-5-[(prop-2-en-1-yl)sulfamoyl]benzoic acid is 790271-07-7.
What is the molecular formula of 2-Bromo-5-[(prop-2-en-1-yl)sulfamoyl]benzoic acid?
The molecular formula of 2-Bromo-5-[(prop-2-en-1-yl)sulfamoyl]benzoic acid is C10H10BrNO4S.
What is the molecular weight of 2-Bromo-5-[(prop-2-en-1-yl)sulfamoyl]benzoic acid?
The molecular weight of 2-Bromo-5-[(prop-2-en-1-yl)sulfamoyl]benzoic acid is 318.95 g/mol.
Where can I buy 2-Bromo-5-[(prop-2-en-1-yl)sulfamoyl]benzoic acid?
You can request a quote for 2-Bromo-5-[(prop-2-en-1-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 2-Bromo-5-[(prop-2-en-1-yl)sulfamoyl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-5-[(prop-2-en-1-yl)sulfamoyl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.