cefamandole
TL;DR: cefamandole (CAS 144125-09-7) is a chemical compound with molecular formula C18H18N6O5S2 and molecular weight 462.078 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(6R,7R)-7-[[(2S)-2-hydroxy-2-phenylacetyl]amino]-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Also Known As: cefamandole, Cefamandole Impurity 19, Cefamandole Impurity 21, (6R,7R)-7-((S)-2-hydroxy-2-phenylacetamido)-3-(((1-methyl-1H-tetrazol-5-yl)thio)methyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7R)-7-[[(2S)-2-hydroxy-2-phenylacetyl]amino]-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Technical Specifications
| Molecular Formula | C18H18N6O5S2 |
| Molecular Weight | 462.078 g/mol |
| XLogP | -0.9 |
| Topological Polar Surface Area (TPSA) | 201.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 462.078 Da |
| Heavy Atoms | 31 |
| Complexity | 777.0 |
| SMILES | CN1C(=NN=N1)SCC2=C(N3[C@@H]([C@@H](C3=O)NC(=O)[C@H](C4=CC=CC=C4)O)SC2)C(=O)O |
| InChIKey | OLVCFLKTBJRLHI-PVXIVEMSSA-N |
Chemical Property Profile of cefamandole
Property Insights of cefamandole
The XLogP value of -0.9 indicates that cefamandole is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 201.0 Ų indicates high polarity, suggesting cefamandole may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, cefamandole has 3 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of cefamandole?
The CAS number of cefamandole is 144125-09-7.
What is the molecular formula of cefamandole?
The molecular formula of cefamandole is C18H18N6O5S2.
What is the molecular weight of cefamandole?
The molecular weight of cefamandole is 462.078 g/mol.
Where can I buy cefamandole?
You can request a quote for cefamandole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for cefamandole?
Yes, CoreyChem provides custom synthesis services for cefamandole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.