4F-401S
TL;DR: 4F-401S (CAS 338419-33-3) is a chemical compound with molecular formula C22H14Cl2FN3O2 and molecular weight 441.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2,4-dichlorophenyl)methyl]-N-(4-fluorophenyl)-3-oxoquinoxaline-2-carboxamide
Also Known As: 4F-401S, 4-(2,4-dichlorobenzyl)-N-(4-fluorophenyl)-3-oxo-3,4-dihydro-2-quinoxalinecarboxamide, 4-[(2,4-dichlorophenyl)methyl]-N-(4-fluorophenyl)-3-oxoquinoxaline-2-carboxamide, 4-[(2,4-dichlorophenyl)methyl]-N-(4-fluorophenyl)-3-oxo-quinoxaline-2-carboxamide, 4-[(2,4-dichlorophenyl)methyl]-N-(4-fluorophenyl)-3-oxo-3,4-dihydroquinoxaline-2-carboxamide
| Molecular Formula | C22H14Cl2FN3O2 |
|---|---|
| Molecular Weight | 441.04 g/mol |
| LogP | 5.143 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 441.0447 |
| Heavy Atoms | 30 |
| Complexity | 1320.5161 |
Chemical Identifiers
| CAS Number | 338419-33-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(C(=O)N2CC3=C(C=C(C=C3)Cl)Cl)C(=O)NC4=CC=C(C=C4)F |
Product Overview
4F-401S (CAS 338419-33-3), with molecular formula C22H14Cl2FN3O2 and molecular weight 441.04 g/mol. IUPAC: 4-[(2,4-dichlorophenyl)methyl]-N-(4-fluorophenyl)-3-oxoquinoxaline-2-carboxamide.
Chemical Property Profile of 4F-401S
Property Insights of 4F-401S
The XLogP value of 5.143 indicates that 4F-401S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 4F-401S. Following Lipinski's Rule of Five, 4F-401S has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4F-401S?
The CAS number of 4F-401S is 338419-33-3.
What is the molecular formula of 4F-401S?
The molecular formula of 4F-401S is C22H14Cl2FN3O2.
What is the molecular weight of 4F-401S?
The molecular weight of 4F-401S is 441.04 g/mol.
Where can I buy 4F-401S?
You can request a quote for 4F-401S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4F-401S?
Yes, KEHONG BIO provides custom synthesis services for 4F-401S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.