![4-[4-(Methylsulfonyl)piperazin-1-yl]-4-oxobutanoic acid structure](/static/products/899/899019-04-6.png)
4-[4-(Methylsulfonyl)piperazin-1-yl]-4-oxobutanoic acid
TL;DR: 4-[4-(Methylsulfonyl)piperazin-1-yl]-4-oxobutanoic acid (CAS 899019-04-6) is a chemical compound with molecular formula C9H16N2O5S and molecular weight 264.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methylsulfonylpiperazin-1-yl)-4-oxobutanoic acid
Also Known As: 4-[4-(methylsulfonyl)piperazin-1-yl]-4-oxobutanoic acid, 4-(4-methanesulfonylpiperazin-1-yl)-4-oxobutanoic acid, 4-(4-methylsulfonylpiperazin-1-yl)-4-oxobutanoic acid, 4-(4-(Methylsulfonyl)piperazin-1-yl)-4-oxobutanoic acid, 4-(4-methylsulfonylpiperazin-1-yl)-4-oxo-butanoic Acid
| Molecular Formula | C9H16N2O5S |
|---|---|
| Molecular Weight | 264.08 g/mol |
| LogP | -1.045 |
| Topological Polar Surface Area | 94.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 264.078 |
| Heavy Atoms | 17 |
| Complexity | 397.60928 |
Chemical Identifiers
| CAS Number | 899019-04-6 |
|---|---|
| SMILES | CS(=O)(=O)N1CCN(CC1)C(=O)CCC(=O)O |
Product Overview
4-[4-(Methylsulfonyl)piperazin-1-yl]-4-oxobutanoic acid (CAS 899019-04-6), with molecular formula C9H16N2O5S and molecular weight 264.08 g/mol. IUPAC: 4-(4-methylsulfonylpiperazin-1-yl)-4-oxobutanoic acid.
Chemical Property Profile of 4-[4-(Methylsulfonyl)piperazin-1-yl]-4-oxobutanoic acid
Property Insights of 4-[4-(Methylsulfonyl)piperazin-1-yl]-4-oxobutanoic acid
The XLogP value of -1.045 indicates that 4-[4-(Methylsulfonyl)piperazin-1-yl]-4-oxobutanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 94.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[4-(Methylsulfonyl)piperazin-1-yl]-4-oxobutanoic acid. Following Lipinski's Rule of Five, 4-[4-(Methylsulfonyl)piperazin-1-yl]-4-oxobutanoic acid has 1 hydrogen bond donor(s) and 4 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 4-[4-(Methylsulfonyl)piperazin-1-yl]-4-oxobutanoic acid?
The CAS number of 4-[4-(Methylsulfonyl)piperazin-1-yl]-4-oxobutanoic acid is 899019-04-6.
What is the molecular formula of 4-[4-(Methylsulfonyl)piperazin-1-yl]-4-oxobutanoic acid?
The molecular formula of 4-[4-(Methylsulfonyl)piperazin-1-yl]-4-oxobutanoic acid is C9H16N2O5S.
What is the molecular weight of 4-[4-(Methylsulfonyl)piperazin-1-yl]-4-oxobutanoic acid?
The molecular weight of 4-[4-(Methylsulfonyl)piperazin-1-yl]-4-oxobutanoic acid is 264.08 g/mol.
Where can I buy 4-[4-(Methylsulfonyl)piperazin-1-yl]-4-oxobutanoic acid?
You can request a quote for 4-[4-(Methylsulfonyl)piperazin-1-yl]-4-oxobutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[4-(Methylsulfonyl)piperazin-1-yl]-4-oxobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[4-(Methylsulfonyl)piperazin-1-yl]-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.