RefChem:372008
TL;DR: RefChem:372008 (CAS 23905-07-9) is a chemical compound with molecular formula C24H26ClN3O4S2 and molecular weight 519.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[2-[(4-chlorophenyl)-phenylmethyl]sulfanylethyl]piperazin-1-yl]-1,3-thiazole;oxalic acid
Also Known As: 1-(2-(alpha-(p-Chlorophenyl)benzylthio)ethyl)-4-(2-thiazolyl)piperazine oxalate, Piperazine, 1-(2-(alpha-(p-chlorophenyl)benzylthio)ethyl)-4-(2-thiazolyl)-, oxalate, 2-[4-[2-[(4-chlorophenyl)-phenylmethyl]sulfanylethyl]piperazin-1-yl]-1,3-thiazole; oxalic acid, Oxalic acid--1-(2-{[(4-chlorophenyl)(phenyl)methyl]sulfanyl}ethyl)-4-(1,3-thiazol-2-yl)piperazine (1/1), Piperazine, 1-[2-[(p-chloro-.alpha.-phenylbenzyl)thio]ethyl]-4-(2-thiazolyl)-, oxalate (1:1)
| Molecular Formula | C24H26ClN3O4S2 |
|---|---|
| Molecular Weight | 519.11 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 148.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 519.10535 |
| Heavy Atoms | 34 |
| Complexity | 519.0 |
Chemical Identifiers
| CAS Number | 23905-07-9 |
|---|---|
| SMILES | C1CN(CCN1CCSC(C2=CC=CC=C2)C3=CC=C(C=C3)Cl)C4=NC=CS4.C(=O)(C(=O)O)O |
| InChIKey | FKPQVJLAFCLIJG-UHFFFAOYSA-N |
Product Overview
RefChem:372008 (CAS 23905-07-9), with molecular formula C24H26ClN3O4S2 and molecular weight 519.11 g/mol. IUPAC: 2-[4-[2-[(4-chlorophenyl)-phenylmethyl]sulfanylethyl]piperazin-1-yl]-1,3-thiazole;oxalic acid.
Chemical Property Profile of RefChem:372008
Property Insights of RefChem:372008
The XLogP value of 4.6 indicates that RefChem:372008 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 148.0 Ų indicates high polarity, suggesting RefChem:372008 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:372008 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:372008?
The CAS number of RefChem:372008 is 23905-07-9.
What is the molecular formula of RefChem:372008?
The molecular formula of RefChem:372008 is C24H26ClN3O4S2.
What is the molecular weight of RefChem:372008?
The molecular weight of RefChem:372008 is 519.11 g/mol.
Where can I buy RefChem:372008?
You can request a quote for RefChem:372008 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:372008?
Yes, KEHONG BIO provides custom synthesis services for RefChem:372008 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.