(Z)-Thiothixene Sulfoxide Dimaleate
TL;DR: (Z)-Thiothixene Sulfoxide Dimaleate (CAS 25616-81-3) is a chemical compound with molecular formula C31H37N3O11S2 and molecular weight 691.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis((Z)-but-2-enedioic acid);(9Z)-N,N-dimethyl-9-[3-(4-methylpiperazin-1-yl)propylidene]-10-oxothioxanthene-2-sulfonamide
Also Known As: cis-Thiothixene oxide dimaleate, (Z)-Thiothixene Sulfoxide Dimaleate, (Z)-but-2-enedioic acid; (9Z)-N,N-dimethyl-9-[3-(4-methylpiperazin-1-yl)propylidene]-10-oxothioxanthene-2-sulfonamide, N,N-Dimethyl-9-[3-(4-methyl-1-piperazinyl)propylidene]thioxanthene-2-sulfonamide 10-Oxide Maleate (1:2), Thioxanthene-2-sulfonamide, N,N-dimethyl-9-(3-(4-methyl-1-piperazinyl)propylidene)-, 10-oxide, dimaleate, (Z)-
| Molecular Formula | C31H37N3O11S2 |
|---|---|
| Molecular Weight | 691.19 g/mol |
| LogP | 1.9098 |
| Topological Polar Surface Area | 210.13 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 691.18695 |
| Heavy Atoms | 47 |
| Complexity | 1625.7227 |
Chemical Identifiers
| CAS Number | 25616-81-3 |
|---|---|
| SMILES | CN1CCN(CC1)CC/C=C/2\C3=C(S(=O)C4=CC=CC=C24)C=CC(=C3)S(=O)(=O)N(C)C.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O |
Product Overview
(Z)-Thiothixene Sulfoxide Dimaleate (CAS 25616-81-3), with molecular formula C31H37N3O11S2 and molecular weight 691.19 g/mol. IUPAC: bis((Z)-but-2-enedioic acid);(9Z)-N,N-dimethyl-9-[3-(4-methylpiperazin-1-yl)propylidene]-10-oxothioxanthene-2-sulfonamide.
Chemical Property Profile of (Z)-Thiothixene Sulfoxide Dimaleate
Property Insights of (Z)-Thiothixene Sulfoxide Dimaleate
The XLogP value of 1.9098 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-Thiothixene Sulfoxide Dimaleate. The TPSA of 210.13 Ų indicates high polarity, suggesting (Z)-Thiothixene Sulfoxide Dimaleate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (Z)-Thiothixene Sulfoxide Dimaleate has 4 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 (Z)-Thiothixene Sulfoxide Dimaleate?
The CAS number of (Z)-Thiothixene Sulfoxide Dimaleate is 25616-81-3.
What is the molecular formula of (Z)-Thiothixene Sulfoxide Dimaleate?
The molecular formula of (Z)-Thiothixene Sulfoxide Dimaleate is C31H37N3O11S2.
What is the molecular weight of (Z)-Thiothixene Sulfoxide Dimaleate?
The molecular weight of (Z)-Thiothixene Sulfoxide Dimaleate is 691.19 g/mol.
Where can I buy (Z)-Thiothixene Sulfoxide Dimaleate?
You can request a quote for (Z)-Thiothixene Sulfoxide Dimaleate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-Thiothixene Sulfoxide Dimaleate?
Yes, KEHONG BIO provides custom synthesis services for (Z)-Thiothixene Sulfoxide Dimaleate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.