2'-[2-(2,2,2-Trifluoroacetamido)ethyl][2,4'-bi-1,3-thiazole]-4-carboxylic acid
TL;DR: 2'-[2-(2,2,2-Trifluoroacetamido)ethyl][2,4'-bi-1,3-thiazole]-4-carboxylic acid (CAS 76275-91-7) is a chemical compound with molecular formula C11H8F3N3O3S2 and molecular weight 351.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[2-[(2,2,2-trifluoroacetyl)amino]ethyl]-1,3-thiazol-4-yl]-1,3-thiazole-4-carboxylic acid
Also Known As: 2'-(2-trifluoroacetamidoethyl)-2,4'-bithiazole-4-carboxylic acid, 2'-[2-(2,2,2-Trifluoroacetamido)ethyl][2,4'-bi-1,3-thiazole]-4-carboxylic acid, 2-[2-[2-[(2,2,2-trifluoroacetyl)amino]ethyl]-1,3-thiazol-4-y, 2-[2-[2-[(2,2,2-trifluoroacetyl)amino]ethyl]-1,3-thiazol-4-yl]-1,3-thiazole-4-carboxylic acid
| Molecular Formula | C11H8F3N3O3S2 |
|---|---|
| Molecular Weight | 351.00 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 149.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 350.9959 |
| Heavy Atoms | 22 |
| Complexity | 439.0 |
Chemical Identifiers
| CAS Number | 76275-91-7 |
|---|---|
| SMILES | C1=C(N=C(S1)CCNC(=O)C(F)(F)F)C2=NC(=CS2)C(=O)O |
| InChIKey | JQEDRNGHFOYUHC-UHFFFAOYSA-N |
Product Overview
2'-[2-(2,2,2-Trifluoroacetamido)ethyl][2,4'-bi-1,3-thiazole]-4-carboxylic acid (CAS 76275-91-7), with molecular formula C11H8F3N3O3S2 and molecular weight 351.00 g/mol. IUPAC: 2-[2-[2-[(2,2,2-trifluoroacetyl)amino]ethyl]-1,3-thiazol-4-yl]-1,3-thiazole-4-carboxylic acid.
Chemical Property Profile of 2'-[2-(2,2,2-Trifluoroacetamido)ethyl][2,4'-bi-1,3-thiazole]-4-carboxylic acid
Property Insights of 2'-[2-(2,2,2-Trifluoroacetamido)ethyl][2,4'-bi-1,3-thiazole]-4-carboxylic acid
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2'-[2-(2,2,2-Trifluoroacetamido)ethyl][2,4'-bi-1,3-thiazole]-4-carboxylic acid. The TPSA of 149.0 Ų indicates high polarity, suggesting 2'-[2-(2,2,2-Trifluoroacetamido)ethyl][2,4'-bi-1,3-thiazole]-4-carboxylic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2'-[2-(2,2,2-Trifluoroacetamido)ethyl][2,4'-bi-1,3-thiazole]-4-carboxylic acid has 2 hydrogen bond donor(s) and 10 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 2'-[2-(2,2,2-Trifluoroacetamido)ethyl][2,4'-bi-1,3-thiazole]-4-carboxylic acid?
The CAS number of 2'-[2-(2,2,2-Trifluoroacetamido)ethyl][2,4'-bi-1,3-thiazole]-4-carboxylic acid is 76275-91-7.
What is the molecular formula of 2'-[2-(2,2,2-Trifluoroacetamido)ethyl][2,4'-bi-1,3-thiazole]-4-carboxylic acid?
The molecular formula of 2'-[2-(2,2,2-Trifluoroacetamido)ethyl][2,4'-bi-1,3-thiazole]-4-carboxylic acid is C11H8F3N3O3S2.
What is the molecular weight of 2'-[2-(2,2,2-Trifluoroacetamido)ethyl][2,4'-bi-1,3-thiazole]-4-carboxylic acid?
The molecular weight of 2'-[2-(2,2,2-Trifluoroacetamido)ethyl][2,4'-bi-1,3-thiazole]-4-carboxylic acid is 351.00 g/mol.
Where can I buy 2'-[2-(2,2,2-Trifluoroacetamido)ethyl][2,4'-bi-1,3-thiazole]-4-carboxylic acid?
You can request a quote for 2'-[2-(2,2,2-Trifluoroacetamido)ethyl][2,4'-bi-1,3-thiazole]-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 2'-[2-(2,2,2-Trifluoroacetamido)ethyl][2,4'-bi-1,3-thiazole]-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2'-[2-(2,2,2-Trifluoroacetamido)ethyl][2,4'-bi-1,3-thiazole]-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.