奥美拉唑
TL;DR: 奥美拉唑 (CAS 73590-58-6) is a chemical compound with molecular formula C17H19N3O3S and molecular weight 345.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
奥美拉唑
6-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methylsulfinyl]-1H-benzimidazole
Also Known As: omeprazole, Esomeprazole, Losec, Prilosec, Antra
| Molecular Formula | C17H19N3O3S |
|---|---|
| Molecular Weight | 345.11 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 96.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 345.11472 |
| Heavy Atoms | 24 |
| Complexity | 453.0 |
| Melting Point | 156 °C |
| Solubility | 0.5 mg/mL |
Chemical Identifiers
| CAS Number | 73590-58-6 |
|---|---|
| SMILES | CC1=CN=C(C(=C1OC)C)CS(=O)C2=NC3=C(N2)C=C(C=C3)OC |
| InChIKey | SUBDBMMJDZJVOS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
奥美拉唑 (CAS 73590-58-6), with molecular formula C17H19N3O3S and molecular weight 345.11 g/mol. IUPAC: 6-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methylsulfinyl]-1H-benzimidazole.
Chemical Property Profile of 奥美拉唑
Property Insights of 奥美拉唑
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 奥美拉唑. The TPSA of 96.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 奥美拉唑. Following Lipinski's Rule of Five, 奥美拉唑 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 奥美拉唑?
The CAS number of 奥美拉唑 is 73590-58-6.
What is the molecular formula of 奥美拉唑?
The molecular formula of 奥美拉唑 is C17H19N3O3S.
What is the molecular weight of 奥美拉唑?
The molecular weight of 奥美拉唑 is 345.11 g/mol.
Where can I buy 奥美拉唑?
You can request a quote for 奥美拉唑 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?
Yes, KEHONG BIO provides custom synthesis services for 奥美拉唑 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.