![3-[3-(2,4,6-Trimethyl-benzenesulfonylamino)-phenyl]-acrylic acid structure](/static/products/1164/1164499-38-0.webp)
3-[3-(2,4,6-Trimethyl-benzenesulfonylamino)-phenyl]-acrylic acid
TL;DR: 3-[3-(2,4,6-Trimethyl-benzenesulfonylamino)-phenyl]-acrylic acid (CAS 1164499-38-0) is a chemical compound with molecular formula C18H19NO4S and molecular weight 345.1035 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-3-[3-[(2,4,6-trimethylphenyl)sulfonylamino]phenyl]prop-2-enoic acid
Also Known As: BAS 01259248, 3-[3-(2,4,6-Trimethyl-benzenesulfonylamino)-phenyl]-acrylic acid, (2E)-3-(3-{[(2,4,6-trimethylphenyl)sulfonyl]amino}phenyl)prop-2-enoic acid, (E)-3-(3-(2,4,6-trimethylphenylsulfonamido)phenyl)acrylic acid, (E)-3-[3-[(2,4,6-trimethylphenyl)sulfonylamino]phenyl]prop-2-enoic acid
Technical Specifications
| Molecular Formula | C18H19NO4S |
| Molecular Weight | 345.1035 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 91.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 345.1035 Da |
| Heavy Atoms | 24 |
| Complexity | 554.0 |
| SMILES | CC1=CC(=C(C(=C1)C)S(=O)(=O)NC2=CC=CC(=C2)/C=C/C(=O)O)C |
| InChIKey | MKFZMVNUDTUTER-BQYQJAHWSA-N |
Chemical Property Profile of 3-[3-(2,4,6-Trimethyl-benzenesulfonylamino)-phenyl]-acrylic acid
Property Insights of 3-[3-(2,4,6-Trimethyl-benzenesulfonylamino)-phenyl]-acrylic acid
The XLogP value of 3.5 indicates that 3-[3-(2,4,6-Trimethyl-benzenesulfonylamino)-phenyl]-acrylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[3-(2,4,6-Trimethyl-benzenesulfonylamino)-phenyl]-acrylic acid. Following Lipinski's Rule of Five, 3-[3-(2,4,6-Trimethyl-benzenesulfonylamino)-phenyl]-acrylic 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
What is the CAS number of 3-[3-(2,4,6-Trimethyl-benzenesulfonylamino)-phenyl]-acrylic acid?
The CAS number of 3-[3-(2,4,6-Trimethyl-benzenesulfonylamino)-phenyl]-acrylic acid is 1164499-38-0.
What is the molecular formula of 3-[3-(2,4,6-Trimethyl-benzenesulfonylamino)-phenyl]-acrylic acid?
The molecular formula of 3-[3-(2,4,6-Trimethyl-benzenesulfonylamino)-phenyl]-acrylic acid is C18H19NO4S.
What is the molecular weight of 3-[3-(2,4,6-Trimethyl-benzenesulfonylamino)-phenyl]-acrylic acid?
The molecular weight of 3-[3-(2,4,6-Trimethyl-benzenesulfonylamino)-phenyl]-acrylic acid is 345.1035 g/mol.
Where can I buy 3-[3-(2,4,6-Trimethyl-benzenesulfonylamino)-phenyl]-acrylic acid?
You can request a quote for 3-[3-(2,4,6-Trimethyl-benzenesulfonylamino)-phenyl]-acrylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-[3-(2,4,6-Trimethyl-benzenesulfonylamino)-phenyl]-acrylic acid?
Yes, CoreyChem provides custom synthesis services for 3-[3-(2,4,6-Trimethyl-benzenesulfonylamino)-phenyl]-acrylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.