F3394-0518
TL;DR: F3394-0518 (CAS 690271-53-5) is a chemical compound with molecular formula C26H21ClN4O3S2 and molecular weight 536.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4-chlorophenyl)-2-[3-([1,2,4]triazolo[4,3-a]quinolin-1-ylsulfanyl)propanoylamino]thiophene-3-carboxylate
Also Known As: F3394-0518, ETHYL 4-(4-CHLOROPHENYL)-2-(3-{[1,2,4]TRIAZOLO[4,3-A]QUINOLIN-1-YLSULFANYL}PROPANAMIDO)THIOPHENE-3-CARBOXYLATE, ethyl 2-(3-([1,2,4]triazolo[4,3-a]quinolin-1-ylthio)propanamido)-4-(4-chlorophenyl)thiophene-3-carboxylate, ethyl 4-(4-chlorophenyl)-2-[3-([1,2,4]triazolo[4,3-a]quinolin-1-ylsulfanyl)propanoylamino]thiophene-3-carboxylate, ethyl 4-(p-chlorophenyl)-2-(3-{2,4,5-triazatricyclo[7.4.0.0(2),]trideca-1(9),3,5,7,10,12-hexaen-3-ylthio}propionylamino)-3-thenoate
| Molecular Formula | C26H21ClN4O3S2 |
|---|---|
| Molecular Weight | 536.07 g/mol |
| LogP | 6.562 |
| Topological Polar Surface Area | 85.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 536.07434 |
| Heavy Atoms | 36 |
| Complexity | 1563.0756 |
Chemical Identifiers
| CAS Number | 690271-53-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Cl)NC(=O)CCSC3=NN=C4N3C5=CC=CC=C5C=C4 |
Product Overview
F3394-0518 (CAS 690271-53-5), with molecular formula C26H21ClN4O3S2 and molecular weight 536.07 g/mol. IUPAC: ethyl 4-(4-chlorophenyl)-2-[3-([1,2,4]triazolo[4,3-a]quinolin-1-ylsulfanyl)propanoylamino]thiophene-3-carboxylate.
Chemical Property Profile of F3394-0518
Property Insights of F3394-0518
The XLogP value of 6.562 indicates that F3394-0518 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 F3394-0518. Following Lipinski's Rule of Five, F3394-0518 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F3394-0518?
The CAS number of F3394-0518 is 690271-53-5.
What is the molecular formula of F3394-0518?
The molecular formula of F3394-0518 is C26H21ClN4O3S2.
What is the molecular weight of F3394-0518?
The molecular weight of F3394-0518 is 536.07 g/mol.
Where can I buy F3394-0518?
You can request a quote for F3394-0518 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3394-0518?
Yes, KEHONG BIO provides custom synthesis services for F3394-0518 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.