KST-1B2109
TL;DR: KST-1B2109 (CAS 24308-56-3) is a chemical compound with molecular formula C27H40Cl2N2O3 and molecular weight 510.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methoxyphenyl)-3-[4-[2-(3-methylbutoxy)-2-phenylethyl]piperazin-1-yl]propan-1-one;dihydrochloride
Also Known As: KST-1B2109, 3-(4-(beta-(Isopentyloxy)phenethyl)-1-piperazinyl)-4'-methoxypropiophenone dihydrochloride, 1-(4-methoxyphenyl)-3-{4-[2-(3-methylbutoxy)-2-phenylethyl]piperazin-1-yl}propan-1-one dihydrochloride, Propiophenone, 3-(4-(beta-(isopentyloxy)phenethyl)-1-piperazinyl)-4'-methoxy-, dihydrochloride, 1-(4-methoxyphenyl)-3-[4-[2-(3-methylbutoxy)-2-phenylethyl]piperazin-1-yl]propan-1-one dihydrochloride
| Molecular Formula | C27H40Cl2N2O3 |
|---|---|
| Molecular Weight | 510.24 g/mol |
| LogP | 5.5332 |
| Topological Polar Surface Area | 42.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Exact Mass | 510.2416 |
| Heavy Atoms | 34 |
| Complexity | 519.0 |
Chemical Identifiers
| CAS Number | 24308-56-3 |
|---|---|
| SMILES | CC(C)CCOC(CN1CCN(CC1)CCC(=O)C2=CC=C(C=C2)OC)C3=CC=CC=C3.Cl.Cl |
| InChIKey | QVNMLYBMNOVYCR-UHFFFAOYSA-N |
Product Overview
KST-1B2109 (CAS 24308-56-3), with molecular formula C27H40Cl2N2O3 and molecular weight 510.24 g/mol. IUPAC: 1-(4-methoxyphenyl)-3-[4-[2-(3-methylbutoxy)-2-phenylethyl]piperazin-1-yl]propan-1-one;dihydrochloride.
Chemical Property Profile of KST-1B2109
Property Insights of KST-1B2109
The XLogP value of 5.5332 indicates that KST-1B2109 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.0 Ų, KST-1B2109 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, KST-1B2109 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of KST-1B2109?
The CAS number of KST-1B2109 is 24308-56-3.
What is the molecular formula of KST-1B2109?
The molecular formula of KST-1B2109 is C27H40Cl2N2O3.
What is the molecular weight of KST-1B2109?
The molecular weight of KST-1B2109 is 510.24 g/mol.
Where can I buy KST-1B2109?
You can request a quote for KST-1B2109 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1B2109?
Yes, KEHONG BIO provides custom synthesis services for KST-1B2109 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.