![3-[4-(3-Trifluoromethyl-phenylsulfamoyl)-phenyl]-acrylic acid structure](/static/products/3797/379729-52-9.webp)
3-[4-(3-Trifluoromethyl-phenylsulfamoyl)-phenyl]-acrylic acid
TL;DR: 3-[4-(3-Trifluoromethyl-phenylsulfamoyl)-phenyl]-acrylic acid (CAS 379729-52-9) is a chemical compound with molecular formula C16H12F3NO4S and molecular weight 371.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-[4-[[3-(trifluoromethyl)phenyl]sulfamoyl]phenyl]prop-2-enoic acid
Also Known As: 3-[4-(3-Trifluoromethyl-phenylsulfamoyl)-phenyl]-acrylic acid, 3-(4-(N-(3-(Trifluoromethyl)phenyl)sulfamoyl)phenyl)acrylic acid, (E)-3-[4-[[3-(trifluoromethyl)phenyl]sulfamoyl]phenyl]prop-2-enoic acid, 3-(4-{[3-(trifluoromethyl)phenyl]sulfamoyl}phenyl)prop-2-enoic acid, 3-[4-(3-trifluoromethylphenylsulfamoyl)phenyl]acrylic acid
| Molecular Formula | C16H12F3NO4S |
|---|---|
| Molecular Weight | 371.04 g/mol |
| LogP | 3.604 |
| Topological Polar Surface Area | 83.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 371.0439 |
| Heavy Atoms | 25 |
| Complexity | 903.7222 |
Chemical Identifiers
| CAS Number | 379729-52-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)/C=C/C(=O)O)C(F)(F)F |
Product Overview
3-[4-(3-Trifluoromethyl-phenylsulfamoyl)-phenyl]-acrylic acid (CAS 379729-52-9), with molecular formula C16H12F3NO4S and molecular weight 371.04 g/mol. IUPAC: (E)-3-[4-[[3-(trifluoromethyl)phenyl]sulfamoyl]phenyl]prop-2-enoic acid.
Chemical Property Profile of 3-[4-(3-Trifluoromethyl-phenylsulfamoyl)-phenyl]-acrylic acid
Property Insights of 3-[4-(3-Trifluoromethyl-phenylsulfamoyl)-phenyl]-acrylic acid
The XLogP value of 3.604 indicates that 3-[4-(3-Trifluoromethyl-phenylsulfamoyl)-phenyl]-acrylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[4-(3-Trifluoromethyl-phenylsulfamoyl)-phenyl]-acrylic acid. Following Lipinski's Rule of Five, 3-[4-(3-Trifluoromethyl-phenylsulfamoyl)-phenyl]-acrylic 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 3-[4-(3-Trifluoromethyl-phenylsulfamoyl)-phenyl]-acrylic acid?
The CAS number of 3-[4-(3-Trifluoromethyl-phenylsulfamoyl)-phenyl]-acrylic acid is 379729-52-9.
What is the molecular formula of 3-[4-(3-Trifluoromethyl-phenylsulfamoyl)-phenyl]-acrylic acid?
The molecular formula of 3-[4-(3-Trifluoromethyl-phenylsulfamoyl)-phenyl]-acrylic acid is C16H12F3NO4S.
What is the molecular weight of 3-[4-(3-Trifluoromethyl-phenylsulfamoyl)-phenyl]-acrylic acid?
The molecular weight of 3-[4-(3-Trifluoromethyl-phenylsulfamoyl)-phenyl]-acrylic acid is 371.04 g/mol.
Where can I buy 3-[4-(3-Trifluoromethyl-phenylsulfamoyl)-phenyl]-acrylic acid?
You can request a quote for 3-[4-(3-Trifluoromethyl-phenylsulfamoyl)-phenyl]-acrylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[4-(3-Trifluoromethyl-phenylsulfamoyl)-phenyl]-acrylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[4-(3-Trifluoromethyl-phenylsulfamoyl)-phenyl]-acrylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.