F3168-1962
TL;DR: F3168-1962 (CAS 688053-76-1) is a chemical compound with molecular formula C22H22ClN3O4S and molecular weight 459.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-chlorophenyl)methyl]-6-(8-oxo-6-sulfanylidene-5H-[1,3]dioxolo[4,5-g]quinazolin-7-yl)hexanamide
Also Known As: F3168-1962, N-[(3-chlorophenyl)methyl]-6-(8-oxo-6-sulfanylidene-5H-[1,3]dioxolo[4,5-g]quinazolin-7-yl)hexanamide, N-[(3-chlorophenyl)methyl]-6-{8-oxo-6-sulfanylidene-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-7-yl}hexanamide, N-(3-chlorobenzyl)-6-(8-oxo-6-thioxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinazolin-7(6H)-yl)hexanamide, N-(3-chlorobenzyl)-6-(8-oxo-6-thioxo-5,6-dihydro-[1,3]dioxolo[4,5-g]quinazolin-7(8H)-yl)hexanamide
| Molecular Formula | C22H22ClN3O4S |
|---|---|
| Molecular Weight | 459.10 g/mol |
| LogP | 4.31799 |
| Topological Polar Surface Area | 85.35 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 459.10196 |
| Heavy Atoms | 31 |
| Complexity | 1237.6337 |
Chemical Identifiers
| CAS Number | 688053-76-1 |
|---|---|
| SMILES | C1OC2=C(O1)C=C3C(=C2)C(=O)N(C(=S)N3)CCCCCC(=O)NCC4=CC(=CC=C4)Cl |
Product Overview
F3168-1962 (CAS 688053-76-1), with molecular formula C22H22ClN3O4S and molecular weight 459.10 g/mol. IUPAC: N-[(3-chlorophenyl)methyl]-6-(8-oxo-6-sulfanylidene-5H-[1,3]dioxolo[4,5-g]quinazolin-7-yl)hexanamide.
Chemical Property Profile of F3168-1962
Property Insights of F3168-1962
The XLogP value of 4.31799 indicates that F3168-1962 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 F3168-1962. Following Lipinski's Rule of Five, F3168-1962 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F3168-1962?
The CAS number of F3168-1962 is 688053-76-1.
What is the molecular formula of F3168-1962?
The molecular formula of F3168-1962 is C22H22ClN3O4S.
What is the molecular weight of F3168-1962?
The molecular weight of F3168-1962 is 459.10 g/mol.
Where can I buy F3168-1962?
You can request a quote for F3168-1962 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3168-1962?
Yes, KEHONG BIO provides custom synthesis services for F3168-1962 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.