KST-1B1692
TL;DR: KST-1B1692 (CAS 21309-10-4) is a chemical compound with molecular formula C22H16F4N2O and molecular weight 400.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2,6-difluorophenyl)methoxymethyl]-1-[(2,6-difluorophenyl)methyl]benzimidazole
Also Known As: KST-1B1692, 1-(2,6-difluorobenzyl)-2-{[(2,6-difluorobenzyl)oxy]methyl}-1h-benzimidazole, 1H-Benzimidazole, 2-(((2,6-difluorophenyl)methoxy)methyl)-1-((2,6-difluorophenyl)methyl)-, ((2,6-Difluorophenyl)methoxy)(1-((2,6-difluorophenyl)methyl)benzimidazol-2-yl)methane, 2-[(2,6-difluorophenyl)methoxymethyl]-1-[(2,6-difluorophenyl)methyl]benzimidazole
| Molecular Formula | C22H16F4N2O |
|---|---|
| Molecular Weight | 400.12 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 27.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 400.11987 |
| Heavy Atoms | 29 |
| Complexity | 507.0 |
Chemical Identifiers
| CAS Number | 21309-10-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(N2CC3=C(C=CC=C3F)F)COCC4=C(C=CC=C4F)F |
| InChIKey | GJYDIIYJGKMSQZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
KST-1B1692 (CAS 21309-10-4), with molecular formula C22H16F4N2O and molecular weight 400.12 g/mol. IUPAC: 2-[(2,6-difluorophenyl)methoxymethyl]-1-[(2,6-difluorophenyl)methyl]benzimidazole.
Chemical Property Profile of KST-1B1692
Property Insights of KST-1B1692
The XLogP value of 4.6 indicates that KST-1B1692 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.1 Ų, KST-1B1692 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, KST-1B1692 has 0 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 KST-1B1692?
The CAS number of KST-1B1692 is 21309-10-4.
What is the molecular formula of KST-1B1692?
The molecular formula of KST-1B1692 is C22H16F4N2O.
What is the molecular weight of KST-1B1692?
The molecular weight of KST-1B1692 is 400.12 g/mol.
Where can I buy KST-1B1692?
You can request a quote for KST-1B1692 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1B1692?
Yes, KEHONG BIO provides custom synthesis services for KST-1B1692 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.