(Z)-1-(2-((3-oxo-2-(thiophen-2-ylmethylene)-2,3-dihydrobenzofuran-6-yl)oxy)acetyl)piperidine-4-carboxylic acid
TL;DR: (Z)-1-(2-((3-oxo-2-(thiophen-2-ylmethylene)-2,3-dihydrobenzofuran-6-yl)oxy)acetyl)piperidine-4-carboxylic acid (CAS 900893-26-7) is a chemical compound with molecular formula C21H19NO6S and molecular weight 413.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-[[(2Z)-3-oxo-2-(thiophen-2-ylmethylidene)-1-benzofuran-6-yl]oxy]acetyl]piperidine-4-carboxylic acid
Also Known As: (Z)-1-(2-((3-oxo-2-(thiophen-2-ylmethylene)-2,3-dihydrobenzofuran-6-yl)oxy)acetyl)piperidine-4-carboxylic acid, 1-({[(2Z)-3-oxo-2-(thiophen-2-ylmethylidene)-2,3-dihydro-1-benzofuran-6-yl]oxy}acetyl)piperidine-4-carboxylic acid, 1-[2-[[(2Z)-3-oxo-2-(thiophen-2-ylmethylidene)-1-benzofuran-6-yl]oxy]acetyl]piperidine-4-carboxylic acid, 1-[2-[3-oxo-2-(thiophen-2-ylmethylidene)benzofuran-6-yl]oxyacetyl]piperidine-4-carboxylic Acid
| Molecular Formula | C21H19NO6S |
|---|---|
| Molecular Weight | 413.09 g/mol |
| LogP | 3.0663 |
| Topological Polar Surface Area | 93.14 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 413.09332 |
| Heavy Atoms | 29 |
| Complexity | 973.06244 |
Chemical Identifiers
| CAS Number | 900893-26-7 |
|---|---|
| SMILES | C1CN(CCC1C(=O)O)C(=O)COC2=CC3=C(C=C2)C(=O)/C(=C/C4=CC=CS4)/O3 |
Product Overview
(Z)-1-(2-((3-oxo-2-(thiophen-2-ylmethylene)-2,3-dihydrobenzofuran-6-yl)oxy)acetyl)piperidine-4-carboxylic acid (CAS 900893-26-7), with molecular formula C21H19NO6S and molecular weight 413.09 g/mol. IUPAC: 1-[2-[[(2Z)-3-oxo-2-(thiophen-2-ylmethylidene)-1-benzofuran-6-yl]oxy]acetyl]piperidine-4-carboxylic acid.
Chemical Property Profile of (Z)-1-(2-((3-oxo-2-(thiophen-2-ylmethylene)-2,3-dihydrobenzofuran-6-yl)oxy)acetyl)piperidine-4-carboxylic acid
Property Insights of (Z)-1-(2-((3-oxo-2-(thiophen-2-ylmethylene)-2,3-dihydrobenzofuran-6-yl)oxy)acetyl)piperidine-4-carboxylic acid
The XLogP value of 3.0663 indicates that (Z)-1-(2-((3-oxo-2-(thiophen-2-ylmethylene)-2,3-dihydrobenzofuran-6-yl)oxy)acetyl)piperidine-4-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.14 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-1-(2-((3-oxo-2-(thiophen-2-ylmethylene)-2,3-dihydrobenzofuran-6-yl)oxy)acetyl)piperidine-4-carboxylic acid. Following Lipinski's Rule of Five, (Z)-1-(2-((3-oxo-2-(thiophen-2-ylmethylene)-2,3-dihydrobenzofuran-6-yl)oxy)acetyl)piperidine-4-carboxylic acid has 1 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 (Z)-1-(2-((3-oxo-2-(thiophen-2-ylmethylene)-2,3-dihydrobenzofuran-6-yl)oxy)acetyl)piperidine-4-carboxylic acid?
The CAS number of (Z)-1-(2-((3-oxo-2-(thiophen-2-ylmethylene)-2,3-dihydrobenzofuran-6-yl)oxy)acetyl)piperidine-4-carboxylic acid is 900893-26-7.
What is the molecular formula of (Z)-1-(2-((3-oxo-2-(thiophen-2-ylmethylene)-2,3-dihydrobenzofuran-6-yl)oxy)acetyl)piperidine-4-carboxylic acid?
The molecular formula of (Z)-1-(2-((3-oxo-2-(thiophen-2-ylmethylene)-2,3-dihydrobenzofuran-6-yl)oxy)acetyl)piperidine-4-carboxylic acid is C21H19NO6S.
What is the molecular weight of (Z)-1-(2-((3-oxo-2-(thiophen-2-ylmethylene)-2,3-dihydrobenzofuran-6-yl)oxy)acetyl)piperidine-4-carboxylic acid?
The molecular weight of (Z)-1-(2-((3-oxo-2-(thiophen-2-ylmethylene)-2,3-dihydrobenzofuran-6-yl)oxy)acetyl)piperidine-4-carboxylic acid is 413.09 g/mol.
Where can I buy (Z)-1-(2-((3-oxo-2-(thiophen-2-ylmethylene)-2,3-dihydrobenzofuran-6-yl)oxy)acetyl)piperidine-4-carboxylic acid?
You can request a quote for (Z)-1-(2-((3-oxo-2-(thiophen-2-ylmethylene)-2,3-dihydrobenzofuran-6-yl)oxy)acetyl)piperidine-4-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-1-(2-((3-oxo-2-(thiophen-2-ylmethylene)-2,3-dihydrobenzofuran-6-yl)oxy)acetyl)piperidine-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for (Z)-1-(2-((3-oxo-2-(thiophen-2-ylmethylene)-2,3-dihydrobenzofuran-6-yl)oxy)acetyl)piperidine-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.