SR 4554
TL;DR: SR 4554 (CAS 167648-73-9) is a chemical compound with molecular formula C8H9F3N4O4 and molecular weight 282.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-nitroimidazol-1-yl)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide
Also Known As: SR 4554, CRC 94/17, CRC-94/17, N-(2-Hydroxy-3,3,3-trifluoropropyl)-2-(2-nitro-1-imidazolyl)acetamide, 2-(2-nitro-1H-imidazol-1-yl)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide
| Molecular Formula | C8H9F3N4O4 |
|---|---|
| Molecular Weight | 282.06 g/mol |
| LogP | -0.1693 |
| Topological Polar Surface Area | 110.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 282.0576 |
| Heavy Atoms | 19 |
| Complexity | 472.80426 |
Chemical Identifiers
| CAS Number | 167648-73-9 |
|---|---|
| SMILES | C1=CN(C(=N1)[N+](=O)[O-])CC(=O)NCC(C(F)(F)F)O |
Product Overview
SR 4554 (CAS 167648-73-9), with molecular formula C8H9F3N4O4 and molecular weight 282.06 g/mol. IUPAC: 2-(2-nitroimidazol-1-yl)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide.
Chemical Property Profile of SR 4554
Property Insights of SR 4554
The XLogP value of -0.1693 indicates that SR 4554 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 110.29 Ų falls within the moderate polarity range, balancing permeability and solubility for SR 4554. Following Lipinski's Rule of Five, SR 4554 has 2 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 SR 4554?
The CAS number of SR 4554 is 167648-73-9.
What is the molecular formula of SR 4554?
The molecular formula of SR 4554 is C8H9F3N4O4.
What is the molecular weight of SR 4554?
The molecular weight of SR 4554 is 282.06 g/mol.
Where can I buy SR 4554?
You can request a quote for SR 4554 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SR 4554?
Yes, KEHONG BIO provides custom synthesis services for SR 4554 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.