Ethyl 2-(3-bromothiophen-2-yl)-1,3-thiazole-4-carboxylate
TL;DR: Ethyl 2-(3-bromothiophen-2-yl)-1,3-thiazole-4-carboxylate (CAS 256508-38-0) is a chemical compound with molecular formula C10H8BrNO2S2 and molecular weight 316.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(3-bromothiophen-2-yl)-1,3-thiazole-4-carboxylate
Also Known As: 4-Thiazolecarboxylicacid,2- -,ethylester, ethyl 2-(3-bromothiophen-2-yl)-1,3-thiazole-4-carboxylate, ethyl 2-(3-bromo-2-thienyl)-1,3-thiazole-4-carboxylate, 4-thiazolecarboxylic acid,2-(3-bromo-2-thienyl)-,ethyl ester, 4-Thiazolecarboxylic acid, 2-(3-bromo-2-thienyl)-, ethyl ester (9CI)
| Molecular Formula | C10H8BrNO2S2 |
|---|---|
| Molecular Weight | 316.92 g/mol |
| LogP | 3.8108 |
| Topological Polar Surface Area | 39.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 316.91797 |
| Heavy Atoms | 16 |
| Complexity | 506.39703 |
Chemical Identifiers
| CAS Number | 256508-38-0 |
|---|---|
| SMILES | CCOC(=O)C1=CSC(=N1)C2=C(C=CS2)Br |
Product Overview
Ethyl 2-(3-bromothiophen-2-yl)-1,3-thiazole-4-carboxylate (CAS 256508-38-0), with molecular formula C10H8BrNO2S2 and molecular weight 316.92 g/mol. IUPAC: ethyl 2-(3-bromothiophen-2-yl)-1,3-thiazole-4-carboxylate.
Chemical Property Profile of Ethyl 2-(3-bromothiophen-2-yl)-1,3-thiazole-4-carboxylate
Property Insights of Ethyl 2-(3-bromothiophen-2-yl)-1,3-thiazole-4-carboxylate
The XLogP value of 3.8108 indicates that Ethyl 2-(3-bromothiophen-2-yl)-1,3-thiazole-4-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.19 Ų, Ethyl 2-(3-bromothiophen-2-yl)-1,3-thiazole-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-(3-bromothiophen-2-yl)-1,3-thiazole-4-carboxylate has 0 hydrogen bond donor(s) and 5 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 Ethyl 2-(3-bromothiophen-2-yl)-1,3-thiazole-4-carboxylate?
The CAS number of Ethyl 2-(3-bromothiophen-2-yl)-1,3-thiazole-4-carboxylate is 256508-38-0.
What is the molecular formula of Ethyl 2-(3-bromothiophen-2-yl)-1,3-thiazole-4-carboxylate?
The molecular formula of Ethyl 2-(3-bromothiophen-2-yl)-1,3-thiazole-4-carboxylate is C10H8BrNO2S2.
What is the molecular weight of Ethyl 2-(3-bromothiophen-2-yl)-1,3-thiazole-4-carboxylate?
The molecular weight of Ethyl 2-(3-bromothiophen-2-yl)-1,3-thiazole-4-carboxylate is 316.92 g/mol.
Where can I buy Ethyl 2-(3-bromothiophen-2-yl)-1,3-thiazole-4-carboxylate?
You can request a quote for Ethyl 2-(3-bromothiophen-2-yl)-1,3-thiazole-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(3-bromothiophen-2-yl)-1,3-thiazole-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(3-bromothiophen-2-yl)-1,3-thiazole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.