![3-{4-[(4-Ethylpiperazin-1-yl)sulfonyl]phenyl}propanoic acid structure](/static/products/104/1044511-26-3.webp)
3-{4-[(4-Ethylpiperazin-1-yl)sulfonyl]phenyl}propanoic acid
TL;DR: 3-{4-[(4-Ethylpiperazin-1-yl)sulfonyl]phenyl}propanoic acid (CAS 1044511-26-3) is a chemical compound with molecular formula C15H22N2O4S and molecular weight 326.13004 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]propanoic acid
Also Known As: 3-{4-[(4-ethylpiperazin-1-yl)sulfonyl]phenyl}propanoic acid, 3-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]propanoic Acid, 3-{4-[(4-ethylpiperazine-1-)sulfonyl]phenyl}propanoic acid, 3-[4-(4-ethylpiperazin-1-ylsulfonyl)phenyl]propanoic acid, 3-[4-(4-ethylpiperazine-1-sulfonyl)phenyl]propanoic acid
Technical Specifications
| Molecular Formula | C15H22N2O4S |
| Molecular Weight | 326.13004 g/mol |
| XLogP | -0.6 |
| Topological Polar Surface Area (TPSA) | 90.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 326.13004 Da |
| Heavy Atoms | 22 |
| Complexity | 453.0 |
| SMILES | CCN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)O |
| InChIKey | VNDFCRJSZVJISG-UHFFFAOYSA-N |
Chemical Property Profile of 3-{4-[(4-Ethylpiperazin-1-yl)sulfonyl]phenyl}propanoic acid
Property Insights of 3-{4-[(4-Ethylpiperazin-1-yl)sulfonyl]phenyl}propanoic acid
The XLogP value of -0.6 indicates that 3-{4-[(4-Ethylpiperazin-1-yl)sulfonyl]phenyl}propanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 90.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{4-[(4-Ethylpiperazin-1-yl)sulfonyl]phenyl}propanoic acid. Following Lipinski's Rule of Five, 3-{4-[(4-Ethylpiperazin-1-yl)sulfonyl]phenyl}propanoic acid has 1 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-{4-[(4-Ethylpiperazin-1-yl)sulfonyl]phenyl}propanoic acid?
The CAS number of 3-{4-[(4-Ethylpiperazin-1-yl)sulfonyl]phenyl}propanoic acid is 1044511-26-3.
What is the molecular formula of 3-{4-[(4-Ethylpiperazin-1-yl)sulfonyl]phenyl}propanoic acid?
The molecular formula of 3-{4-[(4-Ethylpiperazin-1-yl)sulfonyl]phenyl}propanoic acid is C15H22N2O4S.
What is the molecular weight of 3-{4-[(4-Ethylpiperazin-1-yl)sulfonyl]phenyl}propanoic acid?
The molecular weight of 3-{4-[(4-Ethylpiperazin-1-yl)sulfonyl]phenyl}propanoic acid is 326.13004 g/mol.
Where can I buy 3-{4-[(4-Ethylpiperazin-1-yl)sulfonyl]phenyl}propanoic acid?
You can request a quote for 3-{4-[(4-Ethylpiperazin-1-yl)sulfonyl]phenyl}propanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-{4-[(4-Ethylpiperazin-1-yl)sulfonyl]phenyl}propanoic acid?
Yes, CoreyChem provides custom synthesis services for 3-{4-[(4-Ethylpiperazin-1-yl)sulfonyl]phenyl}propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.