S 82-5455
TL;DR: S 82-5455 (CAS 90832-34-1) is a chemical compound with molecular formula C25H24ClF3N4O2 and molecular weight 504.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chloro-10-hydroxy-1-(4-methylpiperazin-1-yl)imino-3-[4-(trifluoromethyl)phenyl]-3,4-dihydro-2H-acridin-9-one
Also Known As: S 82 5455, S 82-5455, 7-chloro-10-hydroxy-1-(4-methylpiperazin-1-yl)imino-3-[4-(trifluoromethyl)phenyl]-3,4-dihydro-2H-acridin-9-one, 7-chloro-1-(4N-methylpiperazino-1N-imino)-10-hydroxy-1,2,3,4-tetrahydro-3-(4-trifluoromethylphenyl)-9(10H)-acridone, (1E)-7-Chloro-10-hydroxy-1-(4-methylpiperazin-1-yl)imino-3-[4-(trifluoromethyl)phenyl]-3,4-dihydro-2H-acridin-9-one
| Molecular Formula | C25H24ClF3N4O2 |
|---|---|
| Molecular Weight | 504.15 g/mol |
| LogP | 4.5925 |
| Topological Polar Surface Area | 61.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 504.154 |
| Heavy Atoms | 35 |
| Complexity | 1360.3602 |
Chemical Identifiers
| CAS Number | 90832-34-1 |
|---|---|
| SMILES | CN1CCN(CC1)N=C2CC(CC3=C2C(=O)C4=C(N3O)C=CC(=C4)Cl)C5=CC=C(C=C5)C(F)(F)F |
Product Overview
S 82-5455 (CAS 90832-34-1), with molecular formula C25H24ClF3N4O2 and molecular weight 504.15 g/mol. IUPAC: 7-chloro-10-hydroxy-1-(4-methylpiperazin-1-yl)imino-3-[4-(trifluoromethyl)phenyl]-3,4-dihydro-2H-acridin-9-one.
Chemical Property Profile of S 82-5455
Property Insights of S 82-5455
The XLogP value of 4.5925 indicates that S 82-5455 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.07 Ų falls within the moderate polarity range, balancing permeability and solubility for S 82-5455. Following Lipinski's Rule of Five, S 82-5455 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of S 82-5455?
The CAS number of S 82-5455 is 90832-34-1.
What is the molecular formula of S 82-5455?
The molecular formula of S 82-5455 is C25H24ClF3N4O2.
What is the molecular weight of S 82-5455?
The molecular weight of S 82-5455 is 504.15 g/mol.
Where can I buy S 82-5455?
You can request a quote for S 82-5455 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S 82-5455?
Yes, KEHONG BIO provides custom synthesis services for S 82-5455 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.