KST-1A2146
TL;DR: KST-1A2146 (CAS 1798-82-9) is a chemical compound with molecular formula C20H21Cl2N3OS and molecular weight 421.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-[(4-aminophenyl)methyl]-5-(3,5-dichlorophenyl)sulfanyl-4-propan-2-ylimidazol-2-yl]methanol
Also Known As: KST-1A2146, 1H-Imidazole-2-methanol, 1-((4-aminophenyl)methyl)-5-((3,5-dichlorophenyl)thio)-4-(1-methylethyl)-, [1-(4-aminobenzyl)-5-[(3,5-dichlorophenyl)sulfanyl]-4-(1-methylethyl)-1h-imidazol-2-yl]methanol, 1-(p-aminobenzyl)-5-(3,5-dichlorophenylthio)-2-hydroxymethyl-4-isopropyl-1H-imidazole, [1-[(4-aminophenyl)methyl]-5-(3,5-dichlorophenyl)sulfanyl-4-isopropyl-imidazol-2-yl]methanol
| Molecular Formula | C20H21Cl2N3OS |
|---|---|
| Molecular Weight | 421.08 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 89.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 421.07825 |
| Heavy Atoms | 27 |
| Complexity | 455.0 |
Chemical Identifiers
| CAS Number | 1798-82-9 |
|---|---|
| SMILES | CC(C)C1=C(N(C(=N1)CO)CC2=CC=C(C=C2)N)SC3=CC(=CC(=C3)Cl)Cl |
| InChIKey | ZGDPGKDUYBCMLP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
KST-1A2146 (CAS 1798-82-9), with molecular formula C20H21Cl2N3OS and molecular weight 421.08 g/mol. IUPAC: [1-[(4-aminophenyl)methyl]-5-(3,5-dichlorophenyl)sulfanyl-4-propan-2-ylimidazol-2-yl]methanol.
Chemical Property Profile of KST-1A2146
Property Insights of KST-1A2146
The XLogP value of 4.9 indicates that KST-1A2146 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.4 Ų falls within the moderate polarity range, balancing permeability and solubility for KST-1A2146. Following Lipinski's Rule of Five, KST-1A2146 has 2 hydrogen bond donor(s) and 4 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-1A2146?
The CAS number of KST-1A2146 is 1798-82-9.
What is the molecular formula of KST-1A2146?
The molecular formula of KST-1A2146 is C20H21Cl2N3OS.
What is the molecular weight of KST-1A2146?
The molecular weight of KST-1A2146 is 421.08 g/mol.
Where can I buy KST-1A2146?
You can request a quote for KST-1A2146 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1A2146?
Yes, KEHONG BIO provides custom synthesis services for KST-1A2146 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.