Acetamide, 2-bromo-N-(5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl)-
TL;DR: Acetamide, 2-bromo-N-(5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl)- (CAS 42458-68-4) is a chemical compound with molecular formula C5H3BrF3N3OS and molecular weight 288.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acetamide
Also Known As: Acetamide, 2-bromo-N-(5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl)-, J1.881.805A, 2-Bromo-N-(5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl)acetamide, 2-bromo-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acetamide, N-[5-(Trifluoromethyl)-1,3,4-thiadiazole-2-yl]-2-bromoacetamide
| Molecular Formula | C5H3BrF3N3OS |
|---|---|
| Molecular Weight | 288.91 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 288.91324 |
| Heavy Atoms | 14 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 42458-68-4 |
|---|---|
| SMILES | C(C(=O)NC1=NN=C(S1)C(F)(F)F)Br |
| InChIKey | QZJANWLGIWMKMO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Acetamide, 2-bromo-N-(5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl)- (CAS 42458-68-4), with molecular formula C5H3BrF3N3OS and molecular weight 288.91 g/mol. IUPAC: 2-bromo-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acetamide.
Chemical Property Profile of Acetamide, 2-bromo-N-(5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl)-
Property Insights of Acetamide, 2-bromo-N-(5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl)-
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetamide, 2-bromo-N-(5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl)-. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetamide, 2-bromo-N-(5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl)-. Following Lipinski's Rule of Five, Acetamide, 2-bromo-N-(5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl)- has 1 hydrogen bond donor(s) and 7 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 Acetamide, 2-bromo-N-(5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl)-?
The CAS number of Acetamide, 2-bromo-N-(5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl)- is 42458-68-4.
What is the molecular formula of Acetamide, 2-bromo-N-(5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl)-?
The molecular formula of Acetamide, 2-bromo-N-(5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl)- is C5H3BrF3N3OS.
What is the molecular weight of Acetamide, 2-bromo-N-(5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl)-?
The molecular weight of Acetamide, 2-bromo-N-(5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl)- is 288.91 g/mol.
Where can I buy Acetamide, 2-bromo-N-(5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl)-?
You can request a quote for Acetamide, 2-bromo-N-(5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetamide, 2-bromo-N-(5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Acetamide, 2-bromo-N-(5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.