4-Oxo-4-((4-(piperidin-1-ylsulfonyl)phenyl)amino)butanoic acid
TL;DR: 4-Oxo-4-((4-(piperidin-1-ylsulfonyl)phenyl)amino)butanoic acid (CAS 791809-62-6) is a chemical compound with molecular formula C15H20N2O5S and molecular weight 340.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxo-4-(4-piperidin-1-ylsulfonylanilino)butanoic acid
Also Known As: 2-(3-Bromophenyl)malondialdehyde, 4-oxo-4-((4-(piperidin-1-ylsulfonyl)phenyl)amino)butanoic acid, N-[4-(Piperidine-1-sulfonyl)-phenyl]-succinamic acid, BAS 02058417, 4-oxo-4-(4-piperidin-1-ylsulfonylanilino)butanoic acid
| Molecular Formula | C15H20N2O5S |
|---|---|
| Molecular Weight | 340.11 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 340.10928 |
| Heavy Atoms | 23 |
| Complexity | 514.0 |
Chemical Identifiers
| CAS Number | 791809-62-6 |
|---|---|
| SMILES | C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC(=O)O |
| InChIKey | TXKJRBUZNKEHNZ-UHFFFAOYSA-N |
Product Overview
4-Oxo-4-((4-(piperidin-1-ylsulfonyl)phenyl)amino)butanoic acid (CAS 791809-62-6), with molecular formula C15H20N2O5S and molecular weight 340.11 g/mol. IUPAC: 4-oxo-4-(4-piperidin-1-ylsulfonylanilino)butanoic acid.
Chemical Property Profile of 4-Oxo-4-((4-(piperidin-1-ylsulfonyl)phenyl)amino)butanoic acid
Property Insights of 4-Oxo-4-((4-(piperidin-1-ylsulfonyl)phenyl)amino)butanoic acid
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Oxo-4-((4-(piperidin-1-ylsulfonyl)phenyl)amino)butanoic acid. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Oxo-4-((4-(piperidin-1-ylsulfonyl)phenyl)amino)butanoic acid. Following Lipinski's Rule of Five, 4-Oxo-4-((4-(piperidin-1-ylsulfonyl)phenyl)amino)butanoic acid has 2 hydrogen bond donor(s) and 6 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-Oxo-4-((4-(piperidin-1-ylsulfonyl)phenyl)amino)butanoic acid?
The CAS number of 4-Oxo-4-((4-(piperidin-1-ylsulfonyl)phenyl)amino)butanoic acid is 791809-62-6.
What is the molecular formula of 4-Oxo-4-((4-(piperidin-1-ylsulfonyl)phenyl)amino)butanoic acid?
The molecular formula of 4-Oxo-4-((4-(piperidin-1-ylsulfonyl)phenyl)amino)butanoic acid is C15H20N2O5S.
What is the molecular weight of 4-Oxo-4-((4-(piperidin-1-ylsulfonyl)phenyl)amino)butanoic acid?
The molecular weight of 4-Oxo-4-((4-(piperidin-1-ylsulfonyl)phenyl)amino)butanoic acid is 340.11 g/mol.
Where can I buy 4-Oxo-4-((4-(piperidin-1-ylsulfonyl)phenyl)amino)butanoic acid?
You can request a quote for 4-Oxo-4-((4-(piperidin-1-ylsulfonyl)phenyl)amino)butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Oxo-4-((4-(piperidin-1-ylsulfonyl)phenyl)amino)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Oxo-4-((4-(piperidin-1-ylsulfonyl)phenyl)amino)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.