SK&F 95448
TL;DR: SK&F 95448 (CAS 5449-11-6) is a chemical compound with molecular formula C16H13F4N3O3S and molecular weight 403.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-methoxy-2-pyridinyl)methylsulfinyl]-6-(1,1,2,2-tetrafluoroethoxy)-1H-benzimidazole
Also Known As: SK&F 95448, SKF-45448-2, B-831-56, 2-(4-Methoxy-2-pyridylmethylsulfinyl)-5-(1,1,2,2-tetrafluoroethoxy)-1H-benzimidazole, 2-{[(4-methoxypyridin-2-yl)methyl]sulfinyl}-6-(1,1,2,2-tetrafluoroethoxy)-1h-benzimidazole
| Molecular Formula | C16H13F4N3O3S |
|---|---|
| Molecular Weight | 403.06 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 96.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 403.06137 |
| Heavy Atoms | 27 |
| Complexity | 531.0 |
Chemical Identifiers
| CAS Number | 5449-11-6 |
|---|---|
| SMILES | COC1=CC(=NC=C1)CS(=O)C2=NC3=C(N2)C=C(C=C3)OC(C(F)F)(F)F |
| InChIKey | IWECCZBOLCDNSE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
SK&F 95448 (CAS 5449-11-6), with molecular formula C16H13F4N3O3S and molecular weight 403.06 g/mol. IUPAC: 2-[(4-methoxy-2-pyridinyl)methylsulfinyl]-6-(1,1,2,2-tetrafluoroethoxy)-1H-benzimidazole.
Chemical Property Profile of SK&F 95448
Property Insights of SK&F 95448
The XLogP value of 3.1 indicates that SK&F 95448 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.3 Ų falls within the moderate polarity range, balancing permeability and solubility for SK&F 95448. Following Lipinski's Rule of Five, SK&F 95448 has 1 hydrogen bond donor(s) and 10 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 SK&F 95448?
The CAS number of SK&F 95448 is 5449-11-6.
What is the molecular formula of SK&F 95448?
The molecular formula of SK&F 95448 is C16H13F4N3O3S.
What is the molecular weight of SK&F 95448?
The molecular weight of SK&F 95448 is 403.06 g/mol.
Where can I buy SK&F 95448?
You can request a quote for SK&F 95448 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SK&F 95448?
Yes, KEHONG BIO provides custom synthesis services for SK&F 95448 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.