Thioxanthene, 2-chloro-9-(3-(pyrrolidinyl)propylidene)-, hydrogen sulfate, (E)-
TL;DR: Thioxanthene, 2-chloro-9-(3-(pyrrolidinyl)propylidene)-, hydrogen sulfate, (E)- (CAS 63869-69-2) is a chemical compound with molecular formula C20H22ClNO4S2 and molecular weight 439.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3E)-3-(2-chlorothioxanthen-9-ylidene)propyl]pyrrolidine;sulfuric acid
Also Known As: N 765 (trans), Thioxanthene, 2-chloro-9-(3-(pyrrolidinyl)propylidene)-, hydrogen sulfate, (E)-, trans-2-Chloro-9-(3-(pyrrolidinyl)propylidene)thioxanthene, hydrogen sulfate, Pyrrolidine, 1-(3-(2-chloro-9H-thioxanthen-9-ylidene)propyl)-, (E)-, sulfate (1:1), 1-[(3E)-3-(2-chlorothioxanthen-9-ylidene)propyl]pyrrolidine; sulfuric acid
| Molecular Formula | C20H22ClNO4S2 |
|---|---|
| Molecular Weight | 439.07 g/mol |
| LogP | 5.0694 |
| Topological Polar Surface Area | 77.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 439.06787 |
| Heavy Atoms | 28 |
| Complexity | 961.921 |
Chemical Identifiers
| CAS Number | 63869-69-2 |
|---|---|
| SMILES | C1CCN(C1)CC/C=C/2\C3=CC=CC=C3SC4=C2C=C(C=C4)Cl.OS(=O)(=O)O |
Product Overview
Thioxanthene, 2-chloro-9-(3-(pyrrolidinyl)propylidene)-, hydrogen sulfate, (E)- (CAS 63869-69-2), with molecular formula C20H22ClNO4S2 and molecular weight 439.07 g/mol. IUPAC: 1-[(3E)-3-(2-chlorothioxanthen-9-ylidene)propyl]pyrrolidine;sulfuric acid.
Chemical Property Profile of Thioxanthene, 2-chloro-9-(3-(pyrrolidinyl)propylidene)-, hydrogen sulfate, (E)-
Property Insights of Thioxanthene, 2-chloro-9-(3-(pyrrolidinyl)propylidene)-, hydrogen sulfate, (E)-
The XLogP value of 5.0694 indicates that Thioxanthene, 2-chloro-9-(3-(pyrrolidinyl)propylidene)-, hydrogen sulfate, (E)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.84 Ų falls within the moderate polarity range, balancing permeability and solubility for Thioxanthene, 2-chloro-9-(3-(pyrrolidinyl)propylidene)-, hydrogen sulfate, (E)-. Following Lipinski's Rule of Five, Thioxanthene, 2-chloro-9-(3-(pyrrolidinyl)propylidene)-, hydrogen sulfate, (E)- has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Thioxanthene, 2-chloro-9-(3-(pyrrolidinyl)propylidene)-, hydrogen sulfate, (E)-?
The CAS number of Thioxanthene, 2-chloro-9-(3-(pyrrolidinyl)propylidene)-, hydrogen sulfate, (E)- is 63869-69-2.
What is the molecular formula of Thioxanthene, 2-chloro-9-(3-(pyrrolidinyl)propylidene)-, hydrogen sulfate, (E)-?
The molecular formula of Thioxanthene, 2-chloro-9-(3-(pyrrolidinyl)propylidene)-, hydrogen sulfate, (E)- is C20H22ClNO4S2.
What is the molecular weight of Thioxanthene, 2-chloro-9-(3-(pyrrolidinyl)propylidene)-, hydrogen sulfate, (E)-?
The molecular weight of Thioxanthene, 2-chloro-9-(3-(pyrrolidinyl)propylidene)-, hydrogen sulfate, (E)- is 439.07 g/mol.
Where can I buy Thioxanthene, 2-chloro-9-(3-(pyrrolidinyl)propylidene)-, hydrogen sulfate, (E)-?
You can request a quote for Thioxanthene, 2-chloro-9-(3-(pyrrolidinyl)propylidene)-, hydrogen sulfate, (E)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thioxanthene, 2-chloro-9-(3-(pyrrolidinyl)propylidene)-, hydrogen sulfate, (E)-?
Yes, KEHONG BIO provides custom synthesis services for Thioxanthene, 2-chloro-9-(3-(pyrrolidinyl)propylidene)-, hydrogen sulfate, (E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.