Piroxicillin
TL;DR: Piroxicillin (CAS 82509-56-6) is a chemical compound with molecular formula C27H28N8O9S2 and molecular weight 672.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,5R,6R)-6-[[2-(4-hydroxyphenyl)-2-[[6-oxo-2-(4-sulfamoylanilino)-1H-pyrimidin-5-yl]carbamoylamino]acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Also Known As: Piroxicillin, Piroxicillin [INN], (2S,5R,6R)-6-[[2-(4-hydroxyphenyl)-2-[[6-oxo-2-(4-sulfamoylanilino)-1H-pyrimidin-5-yl]carbamoylamino]acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
| Molecular Formula | C27H28N8O9S2 |
|---|---|
| Molecular Weight | 672.14 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 295.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 9 |
| Exact Mass | 672.1421 |
| Heavy Atoms | 46 |
| Complexity | 1450.0 |
Chemical Identifiers
| CAS Number | 82509-56-6 |
|---|---|
| SMILES | CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)C(C3=CC=C(C=C3)O)NC(=O)NC4=CN=C(NC4=O)NC5=CC=C(C=C5)S(=O)(=O)N)C(=O)O)C |
| InChIKey | YCDUQXXFNZLWJU-LZSHCIMRSA-N |
Product Overview
Piroxicillin (CAS 82509-56-6), with molecular formula C27H28N8O9S2 and molecular weight 672.14 g/mol. IUPAC: (2S,5R,6R)-6-[[2-(4-hydroxyphenyl)-2-[[6-oxo-2-(4-sulfamoylanilino)-1H-pyrimidin-5-yl]carbamoylamino]acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid.
Chemical Property Profile of Piroxicillin
Property Insights of Piroxicillin
The XLogP value of -0.6 indicates that Piroxicillin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 295.0 Ų indicates high polarity, suggesting Piroxicillin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Piroxicillin has 8 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Piroxicillin?
The CAS number of Piroxicillin is 82509-56-6.
What is the molecular formula of Piroxicillin?
The molecular formula of Piroxicillin is C27H28N8O9S2.
What is the molecular weight of Piroxicillin?
The molecular weight of Piroxicillin is 672.14 g/mol.
Where can I buy Piroxicillin?
You can request a quote for Piroxicillin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piroxicillin?
Yes, KEHONG BIO provides custom synthesis services for Piroxicillin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.