RefChem:234959
TL;DR: RefChem:234959 (CAS 24269-82-7) is a chemical compound with molecular formula C21H30Cl2N2O2S and molecular weight 444.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(1-ethoxy-2-phenylethyl)piperazin-1-yl]-1-thiophen-2-ylpropan-1-one;dihydrochloride
Also Known As: 3-(4-(beta-Ethoxyphenethyl)-1-piperazinyl)-1-(2-thienyl)-1-propanone dihydrochloride, 1-Propanone, 3-(4-(beta-ethoxyphenethyl)-1-piperazinyl)-1-(2-thienyl)-, dihydrochloride, 3-[4-(1-ethoxy-2-phenylethyl)piperazin-1-yl]-1-(thiophen-2-yl)propan-1-one dihydrochloride, 3-[4-(1-ethoxy-2-phenylethyl)piperazin-1-yl]-1-thiophen-2-ylpropan-1-one dihydrochloride, 3-[4-(1-ethoxy-2-phenylethyl)piperazin-1-yl]-1-thiophen-2-ylpropan-1-one,dihydrochloride
| Molecular Formula | C21H30Cl2N2O2S |
|---|---|
| Molecular Weight | 444.14 g/mol |
| LogP | 4.3874 |
| Topological Polar Surface Area | 61.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 444.1405 |
| Heavy Atoms | 28 |
| Complexity | 420.0 |
Chemical Identifiers
| CAS Number | 24269-82-7 |
|---|---|
| SMILES | CCOC(CC1=CC=CC=C1)N2CCN(CC2)CCC(=O)C3=CC=CS3.Cl.Cl |
| InChIKey | CNBHRTMKMYFLFS-UHFFFAOYSA-N |
Product Overview
RefChem:234959 (CAS 24269-82-7), with molecular formula C21H30Cl2N2O2S and molecular weight 444.14 g/mol. IUPAC: 3-[4-(1-ethoxy-2-phenylethyl)piperazin-1-yl]-1-thiophen-2-ylpropan-1-one;dihydrochloride.
Chemical Property Profile of RefChem:234959
Property Insights of RefChem:234959
The XLogP value of 4.3874 indicates that RefChem:234959 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:234959. Following Lipinski's Rule of Five, RefChem:234959 has 2 hydrogen bond donor(s) and 5 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 RefChem:234959?
The CAS number of RefChem:234959 is 24269-82-7.
What is the molecular formula of RefChem:234959?
The molecular formula of RefChem:234959 is C21H30Cl2N2O2S.
What is the molecular weight of RefChem:234959?
The molecular weight of RefChem:234959 is 444.14 g/mol.
Where can I buy RefChem:234959?
You can request a quote for RefChem:234959 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:234959?
Yes, KEHONG BIO provides custom synthesis services for RefChem:234959 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.