Cephalosporin C sodium salt
TL;DR: Cephalosporin C sodium salt (CAS 74970-31-3) is a chemical compound with molecular formula C16H20N3NaO8S and molecular weight 437.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium (6R,7R)-3-(acetyloxymethyl)-7-[[(5R)-5-amino-5-carboxypentanoyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Also Known As: Cephalosporin C sodium salt, CEPHALOSPORIN C SODIUM, (6R,7R)-3-(ACetoxymethyl)-7-((R)-5-amino-5-carboxypentanamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid xsodium salt, sodium (6R,7R)-3-(acetyloxymethyl)-7-[[(5R)-5-amino-6-hydroxy-6-oxohexanoyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
| Molecular Formula | C16H20N3NaO8S |
|---|---|
| Molecular Weight | 437.09 g/mol |
| LogP | -5.4604 |
| Topological Polar Surface Area | 209.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 437.08688 |
| Heavy Atoms | 29 |
| Complexity | 738.0 |
Chemical Identifiers
| CAS Number | 74970-31-3 |
|---|---|
| SMILES | CC(=O)OCC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)CCC[C@H](C(=O)O)N)SC1)C(=O)[O-].[Na+] |
| InChIKey | HZWLVUKHUSRPCG-OOARYINLSA-M |
Product Overview
Cephalosporin C sodium salt (CAS 74970-31-3), with molecular formula C16H20N3NaO8S and molecular weight 437.09 g/mol. IUPAC: sodium (6R,7R)-3-(acetyloxymethyl)-7-[[(5R)-5-amino-5-carboxypentanoyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate.
Chemical Property Profile of Cephalosporin C sodium salt
Property Insights of Cephalosporin C sodium salt
The XLogP value of -5.4604 indicates that Cephalosporin C sodium salt is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 209.0 Ų indicates high polarity, suggesting Cephalosporin C sodium salt may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cephalosporin C sodium salt 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 Cephalosporin C sodium salt?
The CAS number of Cephalosporin C sodium salt is 74970-31-3.
What is the molecular formula of Cephalosporin C sodium salt?
The molecular formula of Cephalosporin C sodium salt is C16H20N3NaO8S.
What is the molecular weight of Cephalosporin C sodium salt?
The molecular weight of Cephalosporin C sodium salt is 437.09 g/mol.
Where can I buy Cephalosporin C sodium salt?
You can request a quote for Cephalosporin C sodium salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cephalosporin C sodium salt?
Yes, KEHONG BIO provides custom synthesis services for Cephalosporin C sodium salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.