Clopenthixol decanoate
TL;DR: Clopenthixol decanoate (CAS 64053-00-5) is a chemical compound with molecular formula C32H43ClN2O2S and molecular weight 554.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[(3E)-3-(2-chlorothioxanthen-9-ylidene)propyl]piperazin-1-yl]ethyl decanoate
Also Known As: Clopenthixol decanoate, Sordinol depot, Ciatyl depot, Clopentixol decanoate, Zuclopenthixol decanoate
| Molecular Formula | C32H43ClN2O2S |
|---|---|
| Molecular Weight | 554.27 g/mol |
| LogP | 7.9279 |
| Topological Polar Surface Area | 32.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 14 |
| Exact Mass | 554.2734 |
| Heavy Atoms | 38 |
| Complexity | 1065.1752 |
Chemical Identifiers
| CAS Number | 64053-00-5 |
|---|---|
| SMILES | CCCCCCCCCC(=O)OCCN1CCN(CC1)CC/C=C/2\C3=CC=CC=C3SC4=C2C=C(C=C4)Cl |
Product Overview
Clopenthixol decanoate (CAS 64053-00-5), with molecular formula C32H43ClN2O2S and molecular weight 554.27 g/mol. IUPAC: 2-[4-[(3E)-3-(2-chlorothioxanthen-9-ylidene)propyl]piperazin-1-yl]ethyl decanoate.
Chemical Property Profile of Clopenthixol decanoate
Property Insights of Clopenthixol decanoate
The XLogP value of 7.9279 indicates that Clopenthixol decanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.78 Ų, Clopenthixol decanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Clopenthixol decanoate has 0 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 Clopenthixol decanoate?
The CAS number of Clopenthixol decanoate is 64053-00-5.
What is the molecular formula of Clopenthixol decanoate?
The molecular formula of Clopenthixol decanoate is C32H43ClN2O2S.
What is the molecular weight of Clopenthixol decanoate?
The molecular weight of Clopenthixol decanoate is 554.27 g/mol.
Where can I buy Clopenthixol decanoate?
You can request a quote for Clopenthixol decanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Clopenthixol decanoate?
Yes, KEHONG BIO provides custom synthesis services for Clopenthixol decanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.