9H-Thioxanthene,2-chloro-9-methylene
TL;DR: 9H-Thioxanthene,2-chloro-9-methylene (CAS 41932-64-3) is a chemical compound with molecular formula C20H25ClN2S and molecular weight 360.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(dimethylamino)ethyl]-2-phenyl-4-phenylsulfanylbutanenitrile;hydrochloride
Also Known As: 9H-Thioxanthene,2-chloro-9-methylene, alpha-(2-Phenylthioethyl)-alpha-(2-dimethylaminoethyl)phenylacetonitrile hydrochloride, alpha-(2-(Dimethylamino)ethyl)-alpha-(2-(phenylthio)ethyl)benzeneacetonitrile hydrochloride, Benzeneacetonitrile, alpha-(2-(dimethylamino)ethyl)-alpha-(2-(phenylthio)ethyl)-, monohydrochloride, 2-(2-dimethylaminoethyl)-2-phenyl-4-phenylsulfanylbutanenitrile hydrochloride
| Molecular Formula | C20H25ClN2S |
|---|---|
| Molecular Weight | 360.14 g/mol |
| LogP | 5.00388 |
| Topological Polar Surface Area | 27.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 360.1427 |
| Heavy Atoms | 24 |
| Complexity | 625.09204 |
Chemical Identifiers
| CAS Number | 41932-64-3 |
|---|---|
| SMILES | CN(C)CCC(CCSC1=CC=CC=C1)(C#N)C2=CC=CC=C2.Cl |
Product Overview
9H-Thioxanthene,2-chloro-9-methylene (CAS 41932-64-3), with molecular formula C20H25ClN2S and molecular weight 360.14 g/mol. IUPAC: 2-[2-(dimethylamino)ethyl]-2-phenyl-4-phenylsulfanylbutanenitrile;hydrochloride.
Chemical Property Profile of 9H-Thioxanthene,2-chloro-9-methylene
Property Insights of 9H-Thioxanthene,2-chloro-9-methylene
The XLogP value of 5.00388 indicates that 9H-Thioxanthene,2-chloro-9-methylene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.03 Ų, 9H-Thioxanthene,2-chloro-9-methylene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9H-Thioxanthene,2-chloro-9-methylene has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 9H-Thioxanthene,2-chloro-9-methylene?
The CAS number of 9H-Thioxanthene,2-chloro-9-methylene is 41932-64-3.
What is the molecular formula of 9H-Thioxanthene,2-chloro-9-methylene?
The molecular formula of 9H-Thioxanthene,2-chloro-9-methylene is C20H25ClN2S.
What is the molecular weight of 9H-Thioxanthene,2-chloro-9-methylene?
The molecular weight of 9H-Thioxanthene,2-chloro-9-methylene is 360.14 g/mol.
Where can I buy 9H-Thioxanthene,2-chloro-9-methylene?
You can request a quote for 9H-Thioxanthene,2-chloro-9-methylene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9H-Thioxanthene,2-chloro-9-methylene?
Yes, KEHONG BIO provides custom synthesis services for 9H-Thioxanthene,2-chloro-9-methylene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.