(E)-4-oxo-4-((4-(piperidin-1-yl)phenyl)amino)but-2-enoic acid
TL;DR: (E)-4-oxo-4-((4-(piperidin-1-yl)phenyl)amino)but-2-enoic acid (CAS 314278-98-3) is a chemical compound with molecular formula C15H18N2O3 and molecular weight 274.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-4-oxo-4-(4-piperidin-1-ylanilino)but-2-enoic acid
Also Known As: BIM-0044307.P001, (E)-4-oxo-4-((4-(piperidin-1-yl)phenyl)amino)but-2-enoic acid, F1065-0170, (E)-3-(N-p-piperidinophenylcarbamoyl)acrylic acid, (E)-4-oxo-4-(4-piperidin-1-ylanilino)but-2-enoic acid
| Molecular Formula | C15H18N2O3 |
|---|---|
| Molecular Weight | 274.13 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 69.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 274.13174 |
| Heavy Atoms | 20 |
| Complexity | 367.0 |
Chemical Identifiers
| CAS Number | 314278-98-3 |
|---|---|
| SMILES | C1CCN(CC1)C2=CC=C(C=C2)NC(=O)/C=C/C(=O)O |
| InChIKey | SVLSMQALWUUSJF-CMDGGOBGSA-N |
Product Overview
(E)-4-oxo-4-((4-(piperidin-1-yl)phenyl)amino)but-2-enoic acid (CAS 314278-98-3), with molecular formula C15H18N2O3 and molecular weight 274.13 g/mol. IUPAC: (E)-4-oxo-4-(4-piperidin-1-ylanilino)but-2-enoic acid.
Chemical Property Profile of (E)-4-oxo-4-((4-(piperidin-1-yl)phenyl)amino)but-2-enoic acid
Property Insights of (E)-4-oxo-4-((4-(piperidin-1-yl)phenyl)amino)but-2-enoic acid
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-4-oxo-4-((4-(piperidin-1-yl)phenyl)amino)but-2-enoic acid. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-4-oxo-4-((4-(piperidin-1-yl)phenyl)amino)but-2-enoic acid. Following Lipinski's Rule of Five, (E)-4-oxo-4-((4-(piperidin-1-yl)phenyl)amino)but-2-enoic acid has 2 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 (E)-4-oxo-4-((4-(piperidin-1-yl)phenyl)amino)but-2-enoic acid?
The CAS number of (E)-4-oxo-4-((4-(piperidin-1-yl)phenyl)amino)but-2-enoic acid is 314278-98-3.
What is the molecular formula of (E)-4-oxo-4-((4-(piperidin-1-yl)phenyl)amino)but-2-enoic acid?
The molecular formula of (E)-4-oxo-4-((4-(piperidin-1-yl)phenyl)amino)but-2-enoic acid is C15H18N2O3.
What is the molecular weight of (E)-4-oxo-4-((4-(piperidin-1-yl)phenyl)amino)but-2-enoic acid?
The molecular weight of (E)-4-oxo-4-((4-(piperidin-1-yl)phenyl)amino)but-2-enoic acid is 274.13 g/mol.
Where can I buy (E)-4-oxo-4-((4-(piperidin-1-yl)phenyl)amino)but-2-enoic acid?
You can request a quote for (E)-4-oxo-4-((4-(piperidin-1-yl)phenyl)amino)but-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-4-oxo-4-((4-(piperidin-1-yl)phenyl)amino)but-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for (E)-4-oxo-4-((4-(piperidin-1-yl)phenyl)amino)but-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.