F3168-1803
TL;DR: F3168-1803 (CAS 422287-35-2) is a chemical compound with molecular formula C26H24BrN3O4S and molecular weight 553.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(6-bromo-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)methyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide
Also Known As: F3168-1803, 4-[(6-bromo-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-3-yl)methyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide, 4-((6-bromo-4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)methyl)-N-(3,4-dimethoxyphenethyl)benzamide, 4-[(6-bromo-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)methyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide
| Molecular Formula | C26H24BrN3O4S |
|---|---|
| Molecular Weight | 553.07 g/mol |
| LogP | 4.85959 |
| Topological Polar Surface Area | 85.35 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 553.0671 |
| Heavy Atoms | 35 |
| Complexity | 1495.7369 |
Chemical Identifiers
| CAS Number | 422287-35-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCNC(=O)C2=CC=C(C=C2)CN3C(=O)C4=C(C=CC(=C4)Br)NC3=S)OC |
Product Overview
F3168-1803 (CAS 422287-35-2), with molecular formula C26H24BrN3O4S and molecular weight 553.07 g/mol. IUPAC: 4-[(6-bromo-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)methyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide.
Chemical Property Profile of F3168-1803
Property Insights of F3168-1803
The XLogP value of 4.85959 indicates that F3168-1803 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.35 Ų falls within the moderate polarity range, balancing permeability and solubility for F3168-1803. Following Lipinski's Rule of Five, F3168-1803 has 2 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 F3168-1803?
The CAS number of F3168-1803 is 422287-35-2.
What is the molecular formula of F3168-1803?
The molecular formula of F3168-1803 is C26H24BrN3O4S.
What is the molecular weight of F3168-1803?
The molecular weight of F3168-1803 is 553.07 g/mol.
Where can I buy F3168-1803?
You can request a quote for F3168-1803 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3168-1803?
Yes, KEHONG BIO provides custom synthesis services for F3168-1803 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.