F3394-0478
TL;DR: F3394-0478 (CAS 671198-85-9) is a chemical compound with molecular formula C25H21ClN2O3S2 and molecular weight 496.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4-chlorophenyl)-2-[[2-(4-methylquinolin-2-yl)sulfanylacetyl]amino]thiophene-3-carboxylate
Also Known As: F3394-0478, ETHYL 4-(4-CHLOROPHENYL)-2-{2-[(4-METHYLQUINOLIN-2-YL)SULFANYL]ACETAMIDO}THIOPHENE-3-CARBOXYLATE, Ethyl 4-(4-chlorophenyl)-2-[[2-(4-methylquinolin-2-yl)sulfanylacetyl]amino]thiophene-3-carboxylate, ethyl 4-(p-chlorophenyl)-2-{[(4-methyl-2-quinolylthio)methyl]carbonylamino}-3-thenoate, ethyl 4-(4-chlorophenyl)-2-({[(4-methylquinolin-2-yl)thio]acetyl}amino)thiophene-3-carboxylate
| Molecular Formula | C25H21ClN2O3S2 |
|---|---|
| Molecular Weight | 496.07 g/mol |
| LogP | 6.83262 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 496.0682 |
| Heavy Atoms | 33 |
| Complexity | 1319.2386 |
Chemical Identifiers
| CAS Number | 671198-85-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Cl)NC(=O)CSC3=NC4=CC=CC=C4C(=C3)C |
Product Overview
F3394-0478 (CAS 671198-85-9), with molecular formula C25H21ClN2O3S2 and molecular weight 496.07 g/mol. IUPAC: ethyl 4-(4-chlorophenyl)-2-[[2-(4-methylquinolin-2-yl)sulfanylacetyl]amino]thiophene-3-carboxylate.
Chemical Property Profile of F3394-0478
Property Insights of F3394-0478
The XLogP value of 6.83262 indicates that F3394-0478 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for F3394-0478. Following Lipinski's Rule of Five, F3394-0478 has 1 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 F3394-0478?
The CAS number of F3394-0478 is 671198-85-9.
What is the molecular formula of F3394-0478?
The molecular formula of F3394-0478 is C25H21ClN2O3S2.
What is the molecular weight of F3394-0478?
The molecular weight of F3394-0478 is 496.07 g/mol.
Where can I buy F3394-0478?
You can request a quote for F3394-0478 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3394-0478?
Yes, KEHONG BIO provides custom synthesis services for F3394-0478 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.