ethyl 4-(4-chlorophenyl)-3-(2-(dicyanomethylene)hydrazinyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylate structure

ethyl 4-(4-chlorophenyl)-3-(2-(dicyanomethylene)hydrazinyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylate

TL;DR: ethyl 4-(4-chlorophenyl)-3-(2-(dicyanomethylene)hydrazinyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylate (CAS 840464-18-8) is a chemical compound with molecular formula C25H16ClN5O2S and molecular weight 485.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

ethyl 4-(4-chlorophenyl)-3-[2-(dicyanomethylidene)hydrazinyl]-6-phenylthieno[2,3-b]pyridine-2-carboxylate

Also Known As: ethyl 4-(4-chlorophenyl)-3-(2-(dicyanomethylene)hydrazinyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylate, ethyl 4-(4-chlorophenyl)-3-[2-(dicyanomethylidene)hydrazinyl]-6-phenylthieno[2,3-b]pyridine-2-carboxylate

CAS: 840464-18-8
Molecular Formula C25H16ClN5O2S
Molecular Weight 485.07 g/mol
LogP 6.27546
Topological Polar Surface Area 111.16 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 8
Rotatable Bonds 6
Exact Mass 485.07132
Heavy Atoms 34
Complexity 1466.5073

Chemical Identifiers

CAS Number 840464-18-8
SMILES CCOC(=O)C1=C(C2=C(S1)N=C(C=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4)NN=C(C#N)C#N

Product Overview

ethyl 4-(4-chlorophenyl)-3-(2-(dicyanomethylene)hydrazinyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylate (CAS 840464-18-8), with molecular formula C25H16ClN5O2S and molecular weight 485.07 g/mol. IUPAC: ethyl 4-(4-chlorophenyl)-3-[2-(dicyanomethylidene)hydrazinyl]-6-phenylthieno[2,3-b]pyridine-2-carboxylate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of ethyl 4-(4-chlorophenyl)-3-(2-(dicyanomethylene)hydrazinyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylate

XLogP
6.27546
TPSA (Topological Polar Surface Area)
111.16
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
8
Rotatable Bonds
6
Heavy Atoms
34
Complexity
1466.5073
Exact Mass
485.07132
Monoisotopic Mass
485.07132
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of ethyl 4-(4-chlorophenyl)-3-(2-(dicyanomethylene)hydrazinyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylate

The XLogP value of 6.27546 indicates that ethyl 4-(4-chlorophenyl)-3-(2-(dicyanomethylene)hydrazinyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.16 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-(4-chlorophenyl)-3-(2-(dicyanomethylene)hydrazinyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylate. Following Lipinski's Rule of Five, ethyl 4-(4-chlorophenyl)-3-(2-(dicyanomethylene)hydrazinyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylate has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of ethyl 4-(4-chlorophenyl)-3-(2-(dicyanomethylene)hydrazinyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylate?

The CAS number of ethyl 4-(4-chlorophenyl)-3-(2-(dicyanomethylene)hydrazinyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylate is 840464-18-8.

What is the molecular formula of ethyl 4-(4-chlorophenyl)-3-(2-(dicyanomethylene)hydrazinyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylate?

The molecular formula of ethyl 4-(4-chlorophenyl)-3-(2-(dicyanomethylene)hydrazinyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylate is C25H16ClN5O2S.

What is the molecular weight of ethyl 4-(4-chlorophenyl)-3-(2-(dicyanomethylene)hydrazinyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylate?

The molecular weight of ethyl 4-(4-chlorophenyl)-3-(2-(dicyanomethylene)hydrazinyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylate is 485.07 g/mol.

Where can I buy ethyl 4-(4-chlorophenyl)-3-(2-(dicyanomethylene)hydrazinyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylate?

You can request a quote for ethyl 4-(4-chlorophenyl)-3-(2-(dicyanomethylene)hydrazinyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for ethyl 4-(4-chlorophenyl)-3-(2-(dicyanomethylene)hydrazinyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylate?

Yes, KEHONG BIO provides custom synthesis services for ethyl 4-(4-chlorophenyl)-3-(2-(dicyanomethylene)hydrazinyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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