F6548-4788
TL;DR: F6548-4788 (CAS 689266-90-8) is a chemical compound with molecular formula C25H22F3N5O2S2 and molecular weight 545.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl]-2-[2-[(2-sulfanylidene-1H-quinazolin-4-yl)amino]-1,3-thiazol-4-yl]ethanone
Also Known As: F6548-4788, 1-(4-hydroxy-4-(3-(trifluoromethyl)phenyl)piperidin-1-yl)-2-(2-((2-thioxo-1,2-dihydroquinazolin-4-yl)amino)thiazol-4-yl)ethanone, 1-[4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl]-2-[2-[(2-sulfanylidene-1H-quinazolin-4-yl)amino]-1,3-thiazol-4-yl]ethanone, 1-{4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl}-2-{2-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]-1,3-thiazol-4-yl}ethan-1-one
| Molecular Formula | C25H22F3N5O2S2 |
|---|---|
| Molecular Weight | 545.12 g/mol |
| LogP | 5.56399 |
| Topological Polar Surface Area | 94.14 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 545.1167 |
| Heavy Atoms | 37 |
| Complexity | 1509.9872 |
Chemical Identifiers
| CAS Number | 689266-90-8 |
|---|---|
| SMILES | C1CN(CCC1(C2=CC(=CC=C2)C(F)(F)F)O)C(=O)CC3=CSC(=N3)NC4=NC(=S)NC5=CC=CC=C54 |
Product Overview
F6548-4788 (CAS 689266-90-8), with molecular formula C25H22F3N5O2S2 and molecular weight 545.12 g/mol. IUPAC: 1-[4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl]-2-[2-[(2-sulfanylidene-1H-quinazolin-4-yl)amino]-1,3-thiazol-4-yl]ethanone.
Chemical Property Profile of F6548-4788
Property Insights of F6548-4788
The XLogP value of 5.56399 indicates that F6548-4788 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.14 Ų falls within the moderate polarity range, balancing permeability and solubility for F6548-4788. Following Lipinski's Rule of Five, F6548-4788 has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F6548-4788?
The CAS number of F6548-4788 is 689266-90-8.
What is the molecular formula of F6548-4788?
The molecular formula of F6548-4788 is C25H22F3N5O2S2.
What is the molecular weight of F6548-4788?
The molecular weight of F6548-4788 is 545.12 g/mol.
Where can I buy F6548-4788?
You can request a quote for F6548-4788 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F6548-4788?
Yes, KEHONG BIO provides custom synthesis services for F6548-4788 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.