Deanxit
TL;DR: Deanxit (CAS 76391-77-0) is a chemical compound with molecular formula C44H50F3N3OS and molecular weight 725.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(10,10-dimethylanthracen-9-ylidene)-N,N-dimethylpropan-1-amine;2-[4-[3-[2-(trifluoromethyl)thioxanthen-9-ylidene]propyl]piperazin-1-yl]ethanol
Also Known As: Deanxit, 3-(10,10-dimethylanthracen-9-ylidene)-N,N-dimethylpropan-1-amine; 2-[4-[(3E)-3-[2-(trifluoromethyl)thioxanthen-9-ylidene]propyl]piperazin-1-yl]ethanol
| Molecular Formula | C44H50F3N3OS |
|---|---|
| Molecular Weight | 725.36 g/mol |
| LogP | 9.311 |
| Topological Polar Surface Area | 55.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 725.3627 |
| Heavy Atoms | 52 |
| Complexity | 970.0 |
Chemical Identifiers
| CAS Number | 76391-77-0 |
|---|---|
| SMILES | CC1(C2=CC=CC=C2C(=CCCN(C)C)C3=CC=CC=C31)C.C1CN(CCN1CCC=C2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F)CCO |
| InChIKey | NECXFGBJNUZGBH-UHFFFAOYSA-N |
Product Overview
Deanxit (CAS 76391-77-0), with molecular formula C44H50F3N3OS and molecular weight 725.36 g/mol. IUPAC: 3-(10,10-dimethylanthracen-9-ylidene)-N,N-dimethylpropan-1-amine;2-[4-[3-[2-(trifluoromethyl)thioxanthen-9-ylidene]propyl]piperazin-1-yl]ethanol.
Chemical Property Profile of Deanxit
Property Insights of Deanxit
The XLogP value of 9.311 indicates that Deanxit is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.3 Ų, Deanxit exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Deanxit has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Deanxit?
The CAS number of Deanxit is 76391-77-0.
What is the molecular formula of Deanxit?
The molecular formula of Deanxit is C44H50F3N3OS.
What is the molecular weight of Deanxit?
The molecular weight of Deanxit is 725.36 g/mol.
Where can I buy Deanxit?
You can request a quote for Deanxit directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Deanxit?
Yes, KEHONG BIO provides custom synthesis services for Deanxit and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.