Cefbuperazone
TL;DR: Cefbuperazone (CAS 8075-95-4) is a chemical compound with molecular formula C22H29N9O9S2 and molecular weight 627.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6R,7S)-7-[[(2R,3S)-2-[(4-ethyl-2,3-dioxopiperazine-1-carbonyl)amino]-3-hydroxybutanoyl]amino]-7-methoxy-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Also Known As: CEFBUPERAZONE, Cefbuperazona, Cefbuperazonum, Cerbuperazone, Cefbuperzaone
| Molecular Formula | C22H29N9O9S2 |
|---|---|
| Molecular Weight | 627.15 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 280.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 10 |
| Exact Mass | 627.15295 |
| Heavy Atoms | 42 |
| Complexity | 1210.0 |
Chemical Identifiers
| CAS Number | 8075-95-4 |
|---|---|
| SMILES | CCN1CCN(C(=O)C1=O)C(=O)N[C@H]([C@H](C)O)C(=O)N[C@]2([C@@H]3N(C2=O)C(=C(CS3)CSC4=NN=NN4C)C(=O)O)OC |
| InChIKey | SMSRCGPDNDCXFR-CYWZMYCQSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cefbuperazone (CAS 8075-95-4), with molecular formula C22H29N9O9S2 and molecular weight 627.15 g/mol. IUPAC: (6R,7S)-7-[[(2R,3S)-2-[(4-ethyl-2,3-dioxopiperazine-1-carbonyl)amino]-3-hydroxybutanoyl]amino]-7-methoxy-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid.
Chemical Property Profile of Cefbuperazone
Property Insights of Cefbuperazone
The XLogP value of -1.0 indicates that Cefbuperazone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 280.0 Ų indicates high polarity, suggesting Cefbuperazone may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cefbuperazone has 4 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cefbuperazone?
The CAS number of Cefbuperazone is 8075-95-4.
What is the molecular formula of Cefbuperazone?
The molecular formula of Cefbuperazone is C22H29N9O9S2.
What is the molecular weight of Cefbuperazone?
The molecular weight of Cefbuperazone is 627.15 g/mol.
Where can I buy Cefbuperazone?
You can request a quote for Cefbuperazone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cefbuperazone?
Yes, KEHONG BIO provides custom synthesis services for Cefbuperazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.