F3168-1746
TL;DR: F3168-1746 (CAS 422279-64-9) is a chemical compound with molecular formula C26H18ClFN4O3S and molecular weight 520.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[(7-chloroquinolin-4-yl)amino]-2-[(3-fluorophenyl)methylsulfanyl]-4-oxoquinazoline-7-carboxylate
Also Known As: F3168-1746, methyl 3-[(7-chloroquinolin-4-yl)amino]-2-{[(3-fluorophenyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carboxylate, methyl 3-((7-chloroquinolin-4-yl)amino)-2-((3-fluorobenzyl)thio)-4-oxo-3,4-dihydroquinazoline-7-carboxylate, methyl 3-[(7-chloroquinolin-4-yl)amino]-2-[(3-fluorophenyl)methylsulfanyl]-4-oxoquinazoline-7-carboxylate
| Molecular Formula | C26H18ClFN4O3S |
|---|---|
| Molecular Weight | 520.08 g/mol |
| LogP | 5.6913 |
| Topological Polar Surface Area | 86.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 520.0772 |
| Heavy Atoms | 36 |
| Complexity | 1692.1617 |
Chemical Identifiers
| CAS Number | 422279-64-9 |
|---|---|
| SMILES | COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC3=CC(=CC=C3)F)NC4=C5C=CC(=CC5=NC=C4)Cl |
Product Overview
F3168-1746 (CAS 422279-64-9), with molecular formula C26H18ClFN4O3S and molecular weight 520.08 g/mol. IUPAC: methyl 3-[(7-chloroquinolin-4-yl)amino]-2-[(3-fluorophenyl)methylsulfanyl]-4-oxoquinazoline-7-carboxylate.
Chemical Property Profile of F3168-1746
Property Insights of F3168-1746
The XLogP value of 5.6913 indicates that F3168-1746 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.11 Ų falls within the moderate polarity range, balancing permeability and solubility for F3168-1746. Following Lipinski's Rule of Five, F3168-1746 has 1 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 F3168-1746?
The CAS number of F3168-1746 is 422279-64-9.
What is the molecular formula of F3168-1746?
The molecular formula of F3168-1746 is C26H18ClFN4O3S.
What is the molecular weight of F3168-1746?
The molecular weight of F3168-1746 is 520.08 g/mol.
Where can I buy F3168-1746?
You can request a quote for F3168-1746 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3168-1746?
Yes, KEHONG BIO provides custom synthesis services for F3168-1746 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.