Sodium Morrhuate
TL;DR: Sodium Morrhuate (CAS 64953-12-4) is a chemical compound with molecular formula C20H18N6Na2O9S and molecular weight 564.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;7-[[2-carboxylato-2-(4-hydroxyphenyl)acetyl]amino]-7-methoxy-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Also Known As: latamoxef sodium, Moxam, Moxalactam sodium salt, moxalactam, Natrii morrhuas
| Molecular Formula | C20H18N6Na2O9S |
|---|---|
| Molecular Weight | 564.07 g/mol |
| LogP | -9.79 |
| Topological Polar Surface Area | 237.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 7 |
| Exact Mass | 564.0651 |
| Heavy Atoms | 38 |
| Complexity | 947.0 |
Chemical Identifiers
| CAS Number | 64953-12-4 |
|---|---|
| SMILES | CN1C(=NN=N1)SCC2=C(N3C(C(C3=O)(NC(=O)C(C4=CC=C(C=C4)O)C(=O)[O-])OC)OC2)C(=O)[O-].[Na+].[Na+] |
| InChIKey | GRIXGZQULWMCLU-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Sodium Morrhuate (CAS 64953-12-4), with molecular formula C20H18N6Na2O9S and molecular weight 564.07 g/mol. IUPAC: disodium;7-[[2-carboxylato-2-(4-hydroxyphenyl)acetyl]amino]-7-methoxy-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate.
Chemical Property Profile of Sodium Morrhuate
Property Insights of Sodium Morrhuate
The XLogP value of -9.79 indicates that Sodium Morrhuate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 237.0 Ų indicates high polarity, suggesting Sodium Morrhuate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Sodium Morrhuate has 2 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Sodium Morrhuate?
The CAS number of Sodium Morrhuate is 64953-12-4.
What is the molecular formula of Sodium Morrhuate?
The molecular formula of Sodium Morrhuate is C20H18N6Na2O9S.
What is the molecular weight of Sodium Morrhuate?
The molecular weight of Sodium Morrhuate is 564.07 g/mol.
Where can I buy Sodium Morrhuate?
You can request a quote for Sodium Morrhuate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sodium Morrhuate?
Yes, KEHONG BIO provides custom synthesis services for Sodium Morrhuate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.