KST-1B2108
TL;DR: KST-1B2108 (CAS 24308-29-0) is a chemical compound with molecular formula C26H37Cl3N2O2 and molecular weight 514.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-3-[4-[2-(3-methylbutoxy)-2-phenylethyl]piperazin-1-yl]propan-1-one;dihydrochloride
Also Known As: KST-1B2108, 4'-Chloro-3-(4-(beta-(isopentyloxy)phenethyl)-1-piperazinyl)propiophenone dihydrochloride, 1-(4-chlorophenyl)-3-{4-[2-(3-methylbutoxy)-2-phenylethyl]piperazin-1-yl}propan-1-one dihydrochloride, Propiophenone, 4'-chloro-3-(4-(beta-(isopentyloxy)phenethyl)-1-piperazinyl)-, dihydrochloride, 1-(4-chlorophenyl)-3-[4-[2-(3-methylbutoxy)-2-phenylethyl]piperazin-1-yl]propan-1-one dihydrochloride
| Molecular Formula | C26H37Cl3N2O2 |
|---|---|
| Molecular Weight | 514.19 g/mol |
| LogP | 6.178 |
| Topological Polar Surface Area | 32.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 514.1921 |
| Heavy Atoms | 33 |
| Complexity | 508.0 |
Chemical Identifiers
| CAS Number | 24308-29-0 |
|---|---|
| SMILES | CC(C)CCOC(CN1CCN(CC1)CCC(=O)C2=CC=C(C=C2)Cl)C3=CC=CC=C3.Cl.Cl |
| InChIKey | SQJZNMSNUJTQIY-UHFFFAOYSA-N |
Product Overview
KST-1B2108 (CAS 24308-29-0), with molecular formula C26H37Cl3N2O2 and molecular weight 514.19 g/mol. IUPAC: 1-(4-chlorophenyl)-3-[4-[2-(3-methylbutoxy)-2-phenylethyl]piperazin-1-yl]propan-1-one;dihydrochloride.
Chemical Property Profile of KST-1B2108
Property Insights of KST-1B2108
The XLogP value of 6.178 indicates that KST-1B2108 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.8 Ų, KST-1B2108 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, KST-1B2108 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of KST-1B2108?
The CAS number of KST-1B2108 is 24308-29-0.
What is the molecular formula of KST-1B2108?
The molecular formula of KST-1B2108 is C26H37Cl3N2O2.
What is the molecular weight of KST-1B2108?
The molecular weight of KST-1B2108 is 514.19 g/mol.
Where can I buy KST-1B2108?
You can request a quote for KST-1B2108 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1B2108?
Yes, KEHONG BIO provides custom synthesis services for KST-1B2108 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.