F3394-0661
TL;DR: F3394-0661 (CAS 690642-67-2) is a chemical compound with molecular formula C28H22ClN5O2S2 and molecular weight 559.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-(4-chlorophenyl)-1,2,4-thiadiazol-3-yl]-2-[(3-cyano-7,7-dimethyl-5-oxo-4-phenyl-6,8-dihydroquinolin-2-yl)sulfanyl]acetamide
Also Known As: F3394-0661, N-[5-(4-chlorophenyl)-1,2,4-thiadiazol-3-yl]-2-[(3-cyano-7,7-dimethyl-5-oxo-4-phenyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetamide, N-(5-(4-chlorophenyl)-1,2,4-thiadiazol-3-yl)-2-((3-cyano-7,7-dimethyl-5-oxo-4-phenyl-5,6,7,8-tetrahydroquinolin-2-yl)thio)acetamide, N-[5-(4-chlorophenyl)-1,2,4-thiadiazol-3-yl]-2-[(3-cyano-7,7-dimethyl-5-oxo-4-phenyl-6,8-dihydroquinolin-2-yl)sulfanyl]acetamide, N-[5-(p-chlorophenyl)-1,2,4-thiadiazol-3-yl](3-cyano-7,7-dimethyl-5-oxo-4-phenyl-5,6,7,8-tetrahydro-2-quinolylthio)acetamide
| Molecular Formula | C28H22ClN5O2S2 |
|---|---|
| Molecular Weight | 559.09 g/mol |
| LogP | 6.67808 |
| Topological Polar Surface Area | 108.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 559.09033 |
| Heavy Atoms | 38 |
| Complexity | 1577.5295 |
Chemical Identifiers
| CAS Number | 690642-67-2 |
|---|---|
| SMILES | CC1(CC2=C(C(=O)C1)C(=C(C(=N2)SCC(=O)NC3=NSC(=N3)C4=CC=C(C=C4)Cl)C#N)C5=CC=CC=C5)C |
Product Overview
F3394-0661 (CAS 690642-67-2), with molecular formula C28H22ClN5O2S2 and molecular weight 559.09 g/mol. IUPAC: N-[5-(4-chlorophenyl)-1,2,4-thiadiazol-3-yl]-2-[(3-cyano-7,7-dimethyl-5-oxo-4-phenyl-6,8-dihydroquinolin-2-yl)sulfanyl]acetamide.
Chemical Property Profile of F3394-0661
Property Insights of F3394-0661
The XLogP value of 6.67808 indicates that F3394-0661 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.63 Ų falls within the moderate polarity range, balancing permeability and solubility for F3394-0661. Following Lipinski's Rule of Five, F3394-0661 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F3394-0661?
The CAS number of F3394-0661 is 690642-67-2.
What is the molecular formula of F3394-0661?
The molecular formula of F3394-0661 is C28H22ClN5O2S2.
What is the molecular weight of F3394-0661?
The molecular weight of F3394-0661 is 559.09 g/mol.
Where can I buy F3394-0661?
You can request a quote for F3394-0661 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3394-0661?
Yes, KEHONG BIO provides custom synthesis services for F3394-0661 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.