F3168-2063
TL;DR: F3168-2063 (CAS 688055-60-9) is a chemical compound with molecular formula C28H28N4O4S and molecular weight 516.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-[benzyl(methyl)amino]propyl]-4-[(8-oxo-6-sulfanylidene-5H-[1,3]dioxolo[4,5-g]quinazolin-7-yl)methyl]benzamide
Also Known As: F3168-2063, N-{3-[benzyl(methyl)amino]propyl}-4-({8-oxo-6-sulfanylidene-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-7-yl}methyl)benzamide, N-(3-(benzyl(methyl)amino)propyl)-4-((8-oxo-6-thioxo-5,6-dihydro-[1,3]dioxolo[4,5-g]quinazolin-7(8H)-yl)methyl)benzamide, N-[3-[benzyl(methyl)amino]propyl]-4-[(8-oxo-6-sulfanylidene-5H-[1,3]dioxolo[4,5-g]quinazolin-7-yl)methyl]benzamide
| Molecular Formula | C28H28N4O4S |
|---|---|
| Molecular Weight | 516.18 g/mol |
| LogP | 4.08799 |
| Topological Polar Surface Area | 88.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 516.1831 |
| Heavy Atoms | 37 |
| Complexity | 1530.6029 |
Chemical Identifiers
| CAS Number | 688055-60-9 |
|---|---|
| SMILES | CN(CCCNC(=O)C1=CC=C(C=C1)CN2C(=O)C3=CC4=C(C=C3NC2=S)OCO4)CC5=CC=CC=C5 |
Product Overview
F3168-2063 (CAS 688055-60-9), with molecular formula C28H28N4O4S and molecular weight 516.18 g/mol. IUPAC: N-[3-[benzyl(methyl)amino]propyl]-4-[(8-oxo-6-sulfanylidene-5H-[1,3]dioxolo[4,5-g]quinazolin-7-yl)methyl]benzamide.
Chemical Property Profile of F3168-2063
Property Insights of F3168-2063
The XLogP value of 4.08799 indicates that F3168-2063 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.59 Ų falls within the moderate polarity range, balancing permeability and solubility for F3168-2063. Following Lipinski's Rule of Five, F3168-2063 has 2 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 F3168-2063?
The CAS number of F3168-2063 is 688055-60-9.
What is the molecular formula of F3168-2063?
The molecular formula of F3168-2063 is C28H28N4O4S.
What is the molecular weight of F3168-2063?
The molecular weight of F3168-2063 is 516.18 g/mol.
Where can I buy F3168-2063?
You can request a quote for F3168-2063 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3168-2063?
Yes, KEHONG BIO provides custom synthesis services for F3168-2063 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.