F3168-1904
TL;DR: F3168-1904 (CAS 689227-29-0) is a chemical compound with molecular formula C23H13BrClN5OS and molecular weight 520.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-bromobenzimidazolo[1,2-c]quinazolin-6-yl)sulfanylmethyl]-7-chloropyrido[1,2-a]pyrimidin-4-one
Also Known As: F3168-1904, 2-[({4-bromo-8,10,17-triazatetracyclo[8.7.0.0^{2,7}.0^{11,16}]heptadeca-1(17),2(7),3,5,8,11(16),12,14-octaen-9-yl}sulfanyl)methyl]-7-chloro-4H-pyrido[1,2-a]pyrimidin-4-one, 2-[(2-bromobenzimidazolo[1,2-c]quinazolin-6-yl)sulfanylmethyl]-7-chloropyrido[1,2-a]pyrimidin-4-one, 2-(((2-bromobenzo[4,5]imidazo[1,2-c]quinazolin-6-yl)thio)methyl)-7-chloro-4H-pyrido[1,2-a]pyrimidin-4-one, 2-{[(2-BROMO[1,3]BENZIMIDAZO[1,2-C]QUINAZOLIN-6-YL)SULFANYL]METHYL}-7-CHLORO-4H-PYRIDO[1,2-A]PYRIMIDIN-4-ONE
| Molecular Formula | C23H13BrClN5OS |
|---|---|
| Molecular Weight | 520.97 g/mol |
| LogP | 5.7518 |
| Topological Polar Surface Area | 64.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 520.97125 |
| Heavy Atoms | 32 |
| Complexity | 1746.3173 |
Chemical Identifiers
| CAS Number | 689227-29-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C3N2C(=NC4=C3C=C(C=C4)Br)SCC5=CC(=O)N6C=C(C=CC6=N5)Cl |
Product Overview
F3168-1904 (CAS 689227-29-0), with molecular formula C23H13BrClN5OS and molecular weight 520.97 g/mol. IUPAC: 2-[(2-bromobenzimidazolo[1,2-c]quinazolin-6-yl)sulfanylmethyl]-7-chloropyrido[1,2-a]pyrimidin-4-one.
Chemical Property Profile of F3168-1904
Property Insights of F3168-1904
The XLogP value of 5.7518 indicates that F3168-1904 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.56 Ų falls within the moderate polarity range, balancing permeability and solubility for F3168-1904. Following Lipinski's Rule of Five, F3168-1904 has 0 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 F3168-1904?
The CAS number of F3168-1904 is 689227-29-0.
What is the molecular formula of F3168-1904?
The molecular formula of F3168-1904 is C23H13BrClN5OS.
What is the molecular weight of F3168-1904?
The molecular weight of F3168-1904 is 520.97 g/mol.
Where can I buy F3168-1904?
You can request a quote for F3168-1904 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3168-1904?
Yes, KEHONG BIO provides custom synthesis services for F3168-1904 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.