Cefedrolor
TL;DR: Cefedrolor (CAS 57848-28-9) is a chemical compound with molecular formula C16H16ClN3O5S and molecular weight 397.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6R,7R)-7-[[(2R)-2-amino-2-(3-chloro-4-hydroxyphenyl)acetyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Also Known As: Cefedrolor, Cefedrolor [INN], cefedrolorum, BMY 25154, KST-1A7038
| Molecular Formula | C16H16ClN3O5S |
|---|---|
| Molecular Weight | 397.05 g/mol |
| LogP | -1.4 |
| Topological Polar Surface Area | 158.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 397.04993 |
| Heavy Atoms | 26 |
| Complexity | 672.0 |
Chemical Identifiers
| CAS Number | 57848-28-9 |
|---|---|
| SMILES | CC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)[C@@H](C3=CC(=C(C=C3)O)Cl)N)SC1)C(=O)O |
| InChIKey | RULITNAIJFZYLO-UEKVPHQBSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cefedrolor (CAS 57848-28-9), with molecular formula C16H16ClN3O5S and molecular weight 397.05 g/mol. IUPAC: (6R,7R)-7-[[(2R)-2-amino-2-(3-chloro-4-hydroxyphenyl)acetyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid.
Chemical Property Profile of Cefedrolor
Property Insights of Cefedrolor
The XLogP value of -1.4 indicates that Cefedrolor is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 158.0 Ų indicates high polarity, suggesting Cefedrolor may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cefedrolor has 4 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 Cefedrolor?
The CAS number of Cefedrolor is 57848-28-9.
What is the molecular formula of Cefedrolor?
The molecular formula of Cefedrolor is C16H16ClN3O5S.
What is the molecular weight of Cefedrolor?
The molecular weight of Cefedrolor is 397.05 g/mol.
Where can I buy Cefedrolor?
You can request a quote for Cefedrolor directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cefedrolor?
Yes, KEHONG BIO provides custom synthesis services for Cefedrolor and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.