Esomeprazole Magnesium
TL;DR: Esomeprazole Magnesium (CAS 1198768-91-0) is a chemical compound with molecular formula C34H36MgN6O6S2 and molecular weight 712.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
magnesium bis(5-methoxy-2-[(S)-(4-methoxy-3,5-dimethyl-2-pyridinyl)methylsulfinyl]benzimidazol-1-ide)
Also Known As: Esomeprazole magnesium, Nexium, Perprazole, Esomeprazole, Esopral
| Molecular Formula | C34H36MgN6O6S2 |
|---|---|
| Molecular Weight | 712.20 g/mol |
| LogP | 4.67688 |
| Topological Polar Surface Area | 150.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 10 |
| Exact Mass | 712.1988 |
| Heavy Atoms | 49 |
| Complexity | 2000.2024 |
Chemical Identifiers
| CAS Number | 1198768-91-0 |
|---|---|
| SMILES | CC1=CN=C(C(=C1OC)C)C[S@](=O)C2=NC3=C([N-]2)C=CC(=C3)OC.CC1=CN=C(C(=C1OC)C)C[S@](=O)C2=NC3=C([N-]2)C=CC(=C3)OC.[Mg+2] |
Product Overview
Esomeprazole Magnesium (CAS 1198768-91-0), with molecular formula C34H36MgN6O6S2 and molecular weight 712.20 g/mol. IUPAC: magnesium bis(5-methoxy-2-[(S)-(4-methoxy-3,5-dimethyl-2-pyridinyl)methylsulfinyl]benzimidazol-1-ide).
Chemical Property Profile of Esomeprazole Magnesium
Property Insights of Esomeprazole Magnesium
The XLogP value of 4.67688 indicates that Esomeprazole Magnesium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 150.82 Ų indicates high polarity, suggesting Esomeprazole Magnesium may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Esomeprazole Magnesium has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Esomeprazole Magnesium?
The CAS number of Esomeprazole Magnesium is 1198768-91-0.
What is the molecular formula of Esomeprazole Magnesium?
The molecular formula of Esomeprazole Magnesium is C34H36MgN6O6S2.
What is the molecular weight of Esomeprazole Magnesium?
The molecular weight of Esomeprazole Magnesium is 712.20 g/mol.
Where can I buy Esomeprazole Magnesium?
You can request a quote for Esomeprazole Magnesium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Esomeprazole Magnesium?
Yes, KEHONG BIO provides custom synthesis services for Esomeprazole Magnesium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.