KST-1B1092
TL;DR: KST-1B1092 (CAS 179113-89-4) is a chemical compound with molecular formula C15H15Cl2F3N2OS and molecular weight 398.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(3,5-dichlorophenyl)sulfanyl-4-propan-2-yl-1-(2,2,2-trifluoroethyl)imidazol-2-yl]methanol
Also Known As: KST-1B1092, (5-(3,5-Dichlorophenylthio)-4-isopropyl-1-(2,2,2-trifluoroethyl)-1H-imidazol-2-yl)methanol, {5-[(3,5-dichlorophenyl)sulfanyl]-4-(1-methylethyl)-1-(2,2,2-trifluoroethyl)-1h-imidazol-2-yl}methanol, [5-(3,5-Dichlorophenylthio)-4-isopropyl-1-(2,2,2-trifluoroethyl)-1H-imidazol-2-yl]methanol, [5-(3,5-dichlorophenyl)sulfanyl-4-isopropyl-1-(2,2,2-trifluoroethyl)imidazol-2-yl]methanol
| Molecular Formula | C15H15Cl2F3N2OS |
|---|---|
| Molecular Weight | 398.02 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 63.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 398.02344 |
| Heavy Atoms | 24 |
| Complexity | 407.0 |
Chemical Identifiers
| CAS Number | 179113-89-4 |
|---|---|
| SMILES | CC(C)C1=C(N(C(=N1)CO)CC(F)(F)F)SC2=CC(=CC(=C2)Cl)Cl |
| InChIKey | QWHBPAKDNQRPIK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
KST-1B1092 (CAS 179113-89-4), with molecular formula C15H15Cl2F3N2OS and molecular weight 398.02 g/mol. IUPAC: [5-(3,5-dichlorophenyl)sulfanyl-4-propan-2-yl-1-(2,2,2-trifluoroethyl)imidazol-2-yl]methanol.
Chemical Property Profile of KST-1B1092
Property Insights of KST-1B1092
The XLogP value of 5.0 indicates that KST-1B1092 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.4 Ų falls within the moderate polarity range, balancing permeability and solubility for KST-1B1092. Following Lipinski's Rule of Five, KST-1B1092 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 KST-1B1092?
The CAS number of KST-1B1092 is 179113-89-4.
What is the molecular formula of KST-1B1092?
The molecular formula of KST-1B1092 is C15H15Cl2F3N2OS.
What is the molecular weight of KST-1B1092?
The molecular weight of KST-1B1092 is 398.02 g/mol.
Where can I buy KST-1B1092?
You can request a quote for KST-1B1092 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1B1092?
Yes, KEHONG BIO provides custom synthesis services for KST-1B1092 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.