泮托拉唑
TL;DR: 泮托拉唑 (CAS 102625-70-7) is a chemical compound with molecular formula C16H15F2N3O4S and molecular weight 383.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
泮托拉唑
6-(difluoromethoxy)-2-[(3,4-dimethoxy-2-pyridinyl)methylsulfinyl]-1H-benzimidazole
Also Known As: pantoprazole, Pantozol, Protonix, Pantoprazol, Pantoloc
| Molecular Formula | C16H15F2N3O4S |
|---|---|
| Molecular Weight | 383.08 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 383.07513 |
| Heavy Atoms | 26 |
| Complexity | 490.0 |
| Melting Point | 149-150 |
| Boiling Point | 586.9±60.0 °C at 760 mmHg |
| Solubility | Freely soluble in water. |
| Vapor Pressure | 1.25X10-12 mm Hg at 25 °C /Estimated/ |
Chemical Identifiers
| CAS Number | 102625-70-7 |
|---|---|
| SMILES | COC1=C(C(=NC=C1)CS(=O)C2=NC3=C(N2)C=C(C=C3)OC(F)F)OC |
| InChIKey | IQPSEEYGBUAQFF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
泮托拉唑 (CAS 102625-70-7), with molecular formula C16H15F2N3O4S and molecular weight 383.08 g/mol. IUPAC: 6-(difluoromethoxy)-2-[(3,4-dimethoxy-2-pyridinyl)methylsulfinyl]-1H-benzimidazole.
Chemical Property Profile of 泮托拉唑
Property Insights of 泮托拉唑
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 泮托拉唑. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 泮托拉唑. Following Lipinski's Rule of Five, 泮托拉唑 has 1 hydrogen bond donor(s) and 9 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 泮托拉唑?
The CAS number of 泮托拉唑 is 102625-70-7.
What is the molecular formula of 泮托拉唑?
The molecular formula of 泮托拉唑 is C16H15F2N3O4S.
What is the molecular weight of 泮托拉唑?
The molecular weight of 泮托拉唑 is 383.08 g/mol.
Where can I buy 泮托拉唑?
You can request a quote for 泮托拉唑 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 泮托拉唑?
Yes, KEHONG BIO provides custom synthesis services for 泮托拉唑 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.