N 769
TL;DR: N 769 (CAS 64047-93-4) is a chemical compound with molecular formula C22H26BrCl3N2OS and molecular weight 550.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[(3E)-3-(2-bromo-7-chlorothioxanthen-9-ylidene)propyl]piperazin-1-yl]ethanol;dihydrochloride
Also Known As: N 769, Thioxanthene, 7-bromo-2-chloro-9-(3-(4-(2-hydroxyethyl)piperazinyl)propylidene)-, dihydrochloride, 1-Piperazineethanol, 4-(3-(2-chloro-7-bromothioxanth-9-ylidene)propyl)-, dihydrochloride, 1-Piperazineethanol, 4-[3-(2-bromo-7-chloro-9H-thioxanthen-9-ylidene)propyl]-, dihydrochloride, 2-[4-[(3E)-3-(2-bromo-7-chlorothioxanthen-9-ylidene)propyl]piperazin-1-yl]ethanol dihydrochloride
| Molecular Formula | C22H26BrCl3N2OS |
|---|---|
| Molecular Weight | 550.00 g/mol |
| LogP | 5.8424 |
| Topological Polar Surface Area | 26.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 550.00146 |
| Heavy Atoms | 30 |
| Complexity | 835.1815 |
Chemical Identifiers
| CAS Number | 64047-93-4 |
|---|---|
| SMILES | C1CN(CCN1CC/C=C/2\C3=C(C=CC(=C3)Cl)SC4=C2C=C(C=C4)Br)CCO.Cl.Cl |
Product Overview
N 769 (CAS 64047-93-4), with molecular formula C22H26BrCl3N2OS and molecular weight 550.00 g/mol. IUPAC: 2-[4-[(3E)-3-(2-bromo-7-chlorothioxanthen-9-ylidene)propyl]piperazin-1-yl]ethanol;dihydrochloride.
Chemical Property Profile of N 769
Property Insights of N 769
The XLogP value of 5.8424 indicates that N 769 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.71 Ų, N 769 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N 769 has 1 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 N 769?
The CAS number of N 769 is 64047-93-4.
What is the molecular formula of N 769?
The molecular formula of N 769 is C22H26BrCl3N2OS.
What is the molecular weight of N 769?
The molecular weight of N 769 is 550.00 g/mol.
Where can I buy N 769?
You can request a quote for N 769 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N 769?
Yes, KEHONG BIO provides custom synthesis services for N 769 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.