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Ethyl 3-(2-chlorobenzamido)-4,5,6-trimethylthieno[2,3-B]pyridine-2-carboxylate
TL;DR: Ethyl 3-(2-chlorobenzamido)-4,5,6-trimethylthieno[2,3-B]pyridine-2-carboxylate (CAS 696625-36-2) is a chemical compound with molecular formula C20H19ClN2O3S and molecular weight 402.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[(2-chlorobenzoyl)amino]-4,5,6-trimethylthieno[2,3-b]pyridine-2-carboxylate
Also Known As: A3392/0143895, ETHYL 3-(2-CHLOROBENZAMIDO)-4,5,6-TRIMETHYLTHIENO[2,3-B]PYRIDINE-2-CARBOXYLATE, ethyl 3-[(2-chlorobenzoyl)amino]-4,5,6-trimethylthieno[2,3-b]pyridine-2-carboxylate, ethyl 3-{[(2-chlorophenyl)carbonyl]amino}-4,5,6-trimethylthieno[2,3-b]pyridine-2-carboxylate
| Molecular Formula | C20H19ClN2O3S |
|---|---|
| Molecular Weight | 402.08 g/mol |
| LogP | 5.30396 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.0805 |
| Heavy Atoms | 27 |
| Complexity | 1059.0518 |
Chemical Identifiers
| CAS Number | 696625-36-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(C2=C(S1)N=C(C(=C2C)C)C)NC(=O)C3=CC=CC=C3Cl |
Product Overview
Ethyl 3-(2-chlorobenzamido)-4,5,6-trimethylthieno[2,3-B]pyridine-2-carboxylate (CAS 696625-36-2), with molecular formula C20H19ClN2O3S and molecular weight 402.08 g/mol. IUPAC: ethyl 3-[(2-chlorobenzoyl)amino]-4,5,6-trimethylthieno[2,3-b]pyridine-2-carboxylate.
Chemical Property Profile of Ethyl 3-(2-chlorobenzamido)-4,5,6-trimethylthieno[2,3-B]pyridine-2-carboxylate
Property Insights of Ethyl 3-(2-chlorobenzamido)-4,5,6-trimethylthieno[2,3-B]pyridine-2-carboxylate
The XLogP value of 5.30396 indicates that Ethyl 3-(2-chlorobenzamido)-4,5,6-trimethylthieno[2,3-B]pyridine-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-(2-chlorobenzamido)-4,5,6-trimethylthieno[2,3-B]pyridine-2-carboxylate. Following Lipinski's Rule of Five, Ethyl 3-(2-chlorobenzamido)-4,5,6-trimethylthieno[2,3-B]pyridine-2-carboxylate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 3-(2-chlorobenzamido)-4,5,6-trimethylthieno[2,3-B]pyridine-2-carboxylate?
The CAS number of Ethyl 3-(2-chlorobenzamido)-4,5,6-trimethylthieno[2,3-B]pyridine-2-carboxylate is 696625-36-2.
What is the molecular formula of Ethyl 3-(2-chlorobenzamido)-4,5,6-trimethylthieno[2,3-B]pyridine-2-carboxylate?
The molecular formula of Ethyl 3-(2-chlorobenzamido)-4,5,6-trimethylthieno[2,3-B]pyridine-2-carboxylate is C20H19ClN2O3S.
What is the molecular weight of Ethyl 3-(2-chlorobenzamido)-4,5,6-trimethylthieno[2,3-B]pyridine-2-carboxylate?
The molecular weight of Ethyl 3-(2-chlorobenzamido)-4,5,6-trimethylthieno[2,3-B]pyridine-2-carboxylate is 402.08 g/mol.
Where can I buy Ethyl 3-(2-chlorobenzamido)-4,5,6-trimethylthieno[2,3-B]pyridine-2-carboxylate?
You can request a quote for Ethyl 3-(2-chlorobenzamido)-4,5,6-trimethylthieno[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 3-(2-chlorobenzamido)-4,5,6-trimethylthieno[2,3-B]pyridine-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-(2-chlorobenzamido)-4,5,6-trimethylthieno[2,3-B]pyridine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.