Desacetylcefotaxime
TL;DR: Desacetylcefotaxime (CAS 66340-28-1) is a chemical compound with molecular formula C14H15N5O6S2 and molecular weight 413.0464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(6R,7R)-7-[[2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Also Known As: Desacetylcefotaxime
Technical Specifications
| Molecular Formula | C14H15N5O6S2 |
| Molecular Weight | 413.0464 g/mol |
| XLogP | -1.9 |
| Topological Polar Surface Area (TPSA) | 221.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 6 |
| Exact Mass | 413.0464 Da |
| Heavy Atoms | 27 |
| Complexity | 729.0 |
| SMILES | CON=C(C1=CSC(=N1)N)C(=O)N[C@H]2[C@@H]3N(C2=O)C(=C(CS3)CO)C(=O)O |
| InChIKey | FHYWAOQGXIZAAF-PRHODGIISA-N |
Chemical Property Profile of Desacetylcefotaxime
Property Insights of Desacetylcefotaxime
The XLogP value of -1.9 indicates that Desacetylcefotaxime is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 221.0 Ų indicates high polarity, suggesting Desacetylcefotaxime may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Desacetylcefotaxime has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Desacetylcefotaxime?
The CAS number of Desacetylcefotaxime is 66340-28-1.
What is the molecular formula of Desacetylcefotaxime?
The molecular formula of Desacetylcefotaxime is C14H15N5O6S2.
What is the molecular weight of Desacetylcefotaxime?
The molecular weight of Desacetylcefotaxime is 413.0464 g/mol.
Where can I buy Desacetylcefotaxime?
You can request a quote for Desacetylcefotaxime directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Desacetylcefotaxime?
Yes, CoreyChem provides custom synthesis services for Desacetylcefotaxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.