奥美拉唑酸
TL;DR: 奥美拉唑酸 (CAS 120003-84-1) is a chemical compound with molecular formula C34H32N6Na2O10S2 and molecular weight 794.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
奥美拉唑酸
disodium bis(4-methoxy-6-[(6-methoxy-1H-benzimidazol-2-yl)sulfinylmethyl]-5-methylpyridine-3-carboxylate)
Also Known As: Omeprazole acid, Omeprazole Acid Disodium Salt, Sodium 4-methoxy-6-[(6-methoxy-1H-benzimidazole-2-sulfinyl)methyl]-5-methylpyridine-3-carboxylate (1/1), disodium 4-methoxy-6-[(6-methoxy-1H-benzimidazol-2-yl)sulfinylmethyl]-5-methylpyridine-3-carboxylate, disodium;4-methoxy-6-[(6-methoxy-1H-benzimidazol-2-yl)sulfinylmethyl]-5-methylpyridine-3-carboxylate
| Molecular Formula | C34H32N6Na2O10S2 |
|---|---|
| Molecular Weight | 794.14 g/mol |
| LogP | -4.08236 |
| Topological Polar Surface Area | 273.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 10 |
| Exact Mass | 794.14166 |
| Heavy Atoms | 54 |
| Complexity | 531.0 |
Chemical Identifiers
| CAS Number | 120003-84-1 |
|---|---|
| SMILES | CC1=C(C(=CN=C1CS(=O)C2=NC3=C(N2)C=C(C=C3)OC)C(=O)[O-])OC.CC1=C(C(=CN=C1CS(=O)C2=NC3=C(N2)C=C(C=C3)OC)C(=O)[O-])OC.[Na+].[Na+] |
| InChIKey | TUCNPUIUNPRUHQ-UHFFFAOYSA-L |
Product Overview
奥美拉唑酸 (CAS 120003-84-1), with molecular formula C34H32N6Na2O10S2 and molecular weight 794.14 g/mol. IUPAC: disodium bis(4-methoxy-6-[(6-methoxy-1H-benzimidazol-2-yl)sulfinylmethyl]-5-methylpyridine-3-carboxylate).
Chemical Property Profile of 奥美拉唑酸
Property Insights of 奥美拉唑酸
The XLogP value of -4.08236 indicates that 奥美拉唑酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 273.0 Ų indicates high polarity, suggesting 奥美拉唑酸 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 奥美拉唑酸 has 2 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 奥美拉唑酸?
The CAS number of 奥美拉唑酸 is 120003-84-1.
What is the molecular formula of 奥美拉唑酸?
The molecular formula of 奥美拉唑酸 is C34H32N6Na2O10S2.
What is the molecular weight of 奥美拉唑酸?
The molecular weight of 奥美拉唑酸 is 794.14 g/mol.
Where can I buy 奥美拉唑酸?
You can request a quote for 奥美拉唑酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 奥美拉唑酸?
Yes, KEHONG BIO provides custom synthesis services for 奥美拉唑酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.