RefChem:186683
TL;DR: RefChem:186683 (CAS 68867-65-2) is a chemical compound with molecular formula C26H46N2O4S and molecular weight 482.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-heptadecyl-1-methylbenzimidazole;methyl hydrogen sulfate
Also Known As: 2-Heptadecyl-1-methylbenzimidazolium methyl sulfate, Sulfuric acid, monomethyl ester, compd. with 2-heptadecyl-1-methyl-1H-benzimidazole (1:1), 2-Heptadecyl-1-methyl-1H-benzimidazole methyl sulphate, 2-Heptadecyl-1-methyl-1H-benzimidazole methyl sulfate, 2-heptadecyl-1-methylbenzimidazole; methyl hydrogen sulfate
| Molecular Formula | C26H46N2O4S |
|---|---|
| Molecular Weight | 482.32 g/mol |
| LogP | 7.42 |
| Topological Polar Surface Area | 89.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 17 |
| Exact Mass | 482.31784 |
| Heavy Atoms | 33 |
| Complexity | 447.0 |
Chemical Identifiers
| CAS Number | 68867-65-2 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC1=NC2=CC=CC=C2N1C.COS(=O)(=O)O |
| InChIKey | XMDZJBIDPCECHF-UHFFFAOYSA-N |
Product Overview
RefChem:186683 (CAS 68867-65-2), with molecular formula C26H46N2O4S and molecular weight 482.32 g/mol. IUPAC: 2-heptadecyl-1-methylbenzimidazole;methyl hydrogen sulfate.
Chemical Property Profile of RefChem:186683
Property Insights of RefChem:186683
The XLogP value of 7.42 indicates that RefChem:186683 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.8 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:186683. Following Lipinski's Rule of Five, RefChem:186683 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:186683?
The CAS number of RefChem:186683 is 68867-65-2.
What is the molecular formula of RefChem:186683?
The molecular formula of RefChem:186683 is C26H46N2O4S.
What is the molecular weight of RefChem:186683?
The molecular weight of RefChem:186683 is 482.32 g/mol.
Where can I buy RefChem:186683?
You can request a quote for RefChem:186683 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:186683?
Yes, KEHONG BIO provides custom synthesis services for RefChem:186683 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.