Cefuracetime
TL;DR: Cefuracetime (CAS 39685-78-4) is a chemical compound with molecular formula C17H17N3O8S and molecular weight 423.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6R,7R)-3-(acetyloxymethyl)-7-[[(2Z)-2-(furan-2-yl)-2-methoxyiminoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Also Known As: Cefuracetime, Cefuracetima, Cefuracetimum, DNP-beta-alanine, Cefuracetime [INN:BAN]
| Molecular Formula | C17H17N3O8S |
|---|---|
| Molecular Weight | 423.07 g/mol |
| LogP | -0.0682 |
| Topological Polar Surface Area | 147.74 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 423.07364 |
| Heavy Atoms | 29 |
| Complexity | 907.78876 |
Chemical Identifiers
| CAS Number | 39685-78-4 |
|---|---|
| SMILES | CC(=O)OCC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)/C(=N\OC)/C3=CC=CO3)SC1)C(=O)O |
Product Overview
Cefuracetime (CAS 39685-78-4), with molecular formula C17H17N3O8S and molecular weight 423.07 g/mol. IUPAC: (6R,7R)-3-(acetyloxymethyl)-7-[[(2Z)-2-(furan-2-yl)-2-methoxyiminoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid.
Chemical Property Profile of Cefuracetime
Property Insights of Cefuracetime
The XLogP value of -0.0682 indicates that Cefuracetime is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 147.74 Ų indicates high polarity, suggesting Cefuracetime may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cefuracetime has 2 hydrogen bond donor(s) and 9 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 Cefuracetime?
The CAS number of Cefuracetime is 39685-78-4.
What is the molecular formula of Cefuracetime?
The molecular formula of Cefuracetime is C17H17N3O8S.
What is the molecular weight of Cefuracetime?
The molecular weight of Cefuracetime is 423.07 g/mol.
Where can I buy Cefuracetime?
You can request a quote for Cefuracetime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cefuracetime?
Yes, KEHONG BIO provides custom synthesis services for Cefuracetime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.