AF-399/42255406
TL;DR: AF-399/42255406 (CAS 620539-87-9) is a chemical compound with molecular formula C22H14FN3O3S and molecular weight 419.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-2-(2H-chromen-3-ylmethylidene)-6-[(4-fluorophenyl)methyl]-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione
Also Known As: AF-399/42255406, (2E)-2-(2H-chromen-3-ylmethylidene)-6-[(4-fluorophenyl)methyl]-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione, 2-(2H-chromen-3-ylmethylene)-6-(4-fluorobenzyl)-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione, (2E)-2-[(2H-CHROMEN-3-YL)METHYLIDENE]-6-[(4-FLUOROPHENYL)METHYL]-2H,3H,7H-[1,3]THIAZOLO[3,2-B][1,2,4]TRIAZINE-3,7-DIONE, (E)-2-((2H-chromen-3-yl)methylene)-6-(4-fluorobenzyl)-2H-thiazolo[3,2-b][1,2,4]triazine-3,7-dione
| Molecular Formula | C22H14FN3O3S |
|---|---|
| Molecular Weight | 419.07 g/mol |
| LogP | 2.2165 |
| Topological Polar Surface Area | 73.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 419.074 |
| Heavy Atoms | 30 |
| Complexity | 1472.528 |
Chemical Identifiers
| CAS Number | 620539-87-9 |
|---|---|
| SMILES | C1C(=CC2=CC=CC=C2O1)/C=C/3\C(=O)N4C(=NC(=O)C(=N4)CC5=CC=C(C=C5)F)S3 |
Product Overview
AF-399/42255406 (CAS 620539-87-9), with molecular formula C22H14FN3O3S and molecular weight 419.07 g/mol. IUPAC: (2E)-2-(2H-chromen-3-ylmethylidene)-6-[(4-fluorophenyl)methyl]-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione.
Chemical Property Profile of AF-399/42255406
Property Insights of AF-399/42255406
The XLogP value of 2.2165 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AF-399/42255406. The TPSA of 73.56 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/42255406. Following Lipinski's Rule of Five, AF-399/42255406 has 0 hydrogen bond donor(s) and 6 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 AF-399/42255406?
The CAS number of AF-399/42255406 is 620539-87-9.
What is the molecular formula of AF-399/42255406?
The molecular formula of AF-399/42255406 is C22H14FN3O3S.
What is the molecular weight of AF-399/42255406?
The molecular weight of AF-399/42255406 is 419.07 g/mol.
Where can I buy AF-399/42255406?
You can request a quote for AF-399/42255406 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/42255406?
Yes, KEHONG BIO provides custom synthesis services for AF-399/42255406 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.