F3168-1912
TL;DR: F3168-1912 (CAS 422290-05-9) is a chemical compound with molecular formula C25H19BrN4O3S and molecular weight 534.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[2-(2-bromobenzimidazolo[1,2-c]quinazolin-6-yl)sulfanylacetyl]amino]benzoate
Also Known As: F3168-1912, ethyl 4-[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)acetamido]benzoate, ethyl 4-[[2-(2-bromobenzimidazolo[1,2-c]quinazolin-6-yl)sulfanylacetyl]amino]benzoate, ethyl 4-({[(2-bromobenzimidazo[1,2-c]quinazolin-6-yl)thio]acetyl}amino)benzoate, ethyl 4-(2-((2-bromobenzo[4,5]imidazo[1,2-c]quinazolin-6-yl)thio)acetamido)benzoate
| Molecular Formula | C25H19BrN4O3S |
|---|---|
| Molecular Weight | 534.04 g/mol |
| LogP | 5.7057 |
| Topological Polar Surface Area | 85.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 534.03613 |
| Heavy Atoms | 34 |
| Complexity | 1549.4994 |
Chemical Identifiers
| CAS Number | 422290-05-9 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C=C(C=C3)Br)C4=NC5=CC=CC=C5N42 |
Product Overview
F3168-1912 (CAS 422290-05-9), with molecular formula C25H19BrN4O3S and molecular weight 534.04 g/mol. IUPAC: ethyl 4-[[2-(2-bromobenzimidazolo[1,2-c]quinazolin-6-yl)sulfanylacetyl]amino]benzoate.
Chemical Property Profile of F3168-1912
Property Insights of F3168-1912
The XLogP value of 5.7057 indicates that F3168-1912 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.59 Ų falls within the moderate polarity range, balancing permeability and solubility for F3168-1912. Following Lipinski's Rule of Five, F3168-1912 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F3168-1912?
The CAS number of F3168-1912 is 422290-05-9.
What is the molecular formula of F3168-1912?
The molecular formula of F3168-1912 is C25H19BrN4O3S.
What is the molecular weight of F3168-1912?
The molecular weight of F3168-1912 is 534.04 g/mol.
Where can I buy F3168-1912?
You can request a quote for F3168-1912 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3168-1912?
Yes, KEHONG BIO provides custom synthesis services for F3168-1912 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.