KST-1B1122
TL;DR: KST-1B1122 (CAS 17954-31-3) is a chemical compound with molecular formula C15H19Cl2N3 and molecular weight 311.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-[(3,5-dichlorophenyl)methyl]-1-methyl-4-propan-2-ylimidazol-2-yl]methanamine
Also Known As: KST-1B1122, 1H-Imidazole-2-methanamine, 5-((3,5-dichlorophenyl)methyl)-1-methyl-4-(1-methylethyl)-, 1-[5-(3,5-dichlorobenzyl)-1-methyl-4-(1-methylethyl)-1h-imidazol-2-yl]methanamine, [5-[(3,5-dichlorophenyl)methyl]-1-methyl-4-propan-2-ylimidazol-2-yl]methanamine, 2-aminomethyl-5-(3,5-dichlorobenzyl)-4-isopropyl-1-methyl-1H-imidazole
| Molecular Formula | C15H19Cl2N3 |
|---|---|
| Molecular Weight | 311.10 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 43.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 311.0956 |
| Heavy Atoms | 20 |
| Complexity | 303.0 |
Chemical Identifiers
| CAS Number | 17954-31-3 |
|---|---|
| SMILES | CC(C)C1=C(N(C(=N1)CN)C)CC2=CC(=CC(=C2)Cl)Cl |
| InChIKey | ZUEYJHOPIHATGY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
KST-1B1122 (CAS 17954-31-3), with molecular formula C15H19Cl2N3 and molecular weight 311.10 g/mol. IUPAC: [5-[(3,5-dichlorophenyl)methyl]-1-methyl-4-propan-2-ylimidazol-2-yl]methanamine.
Chemical Property Profile of KST-1B1122
Property Insights of KST-1B1122
The XLogP value of 3.3 indicates that KST-1B1122 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.8 Ų, KST-1B1122 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, KST-1B1122 has 1 hydrogen bond donor(s) and 2 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-1B1122?
The CAS number of KST-1B1122 is 17954-31-3.
What is the molecular formula of KST-1B1122?
The molecular formula of KST-1B1122 is C15H19Cl2N3.
What is the molecular weight of KST-1B1122?
The molecular weight of KST-1B1122 is 311.10 g/mol.
Where can I buy KST-1B1122?
You can request a quote for KST-1B1122 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1B1122?
Yes, KEHONG BIO provides custom synthesis services for KST-1B1122 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.