AF-399/40960407
TL;DR: AF-399/40960407 (CAS 433327-67-4) is a chemical compound with molecular formula C20H18FN3O4S and molecular weight 415.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-fluorophenyl)-5-(3,4,5-trimethoxyphenyl)-5,6-dihydro-[1,2,4]triazolo[5,1-b][1,3]thiazin-7-one
Also Known As: AF-399/40960407, 2-(4-fluorophenyl)-5-(3,4,5-trimethoxyphenyl)-5,6-dihydro-7H-[1,2,4]triazolo[5,1-b][1,3]thiazin-7-one, 2-(4-fluorophenyl)-5-(3,4,5-trimethoxyphenyl)-5,6-dihydro-[1,2,4]triazolo[5,1-b][1,3]thiazin-7-one, 2-(4-FLUOROPHENYL)-5-(3,4,5-TRIMETHOXYPHENYL)-5H,6H,7H-[1,2,4]TRIAZOLO[3,2-B][1,3]THIAZIN-7-ONE, 2-(4-fluorophenyl)-5-(3,4,5-trimethoxyphenyl)-5H,6H-1,2,4-triazolo[5,1-b]1,3-t hiazaperhydroin-7-one
| Molecular Formula | C20H18FN3O4S |
|---|---|
| Molecular Weight | 415.10 g/mol |
| LogP | 3.9873 |
| Topological Polar Surface Area | 75.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 415.10022 |
| Heavy Atoms | 29 |
| Complexity | 1043.0834 |
Chemical Identifiers
| CAS Number | 433327-67-4 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C2CC(=O)N3C(=NC(=N3)C4=CC=C(C=C4)F)S2 |
Product Overview
AF-399/40960407 (CAS 433327-67-4), with molecular formula C20H18FN3O4S and molecular weight 415.10 g/mol. IUPAC: 2-(4-fluorophenyl)-5-(3,4,5-trimethoxyphenyl)-5,6-dihydro-[1,2,4]triazolo[5,1-b][1,3]thiazin-7-one.
Chemical Property Profile of AF-399/40960407
Property Insights of AF-399/40960407
The XLogP value of 3.9873 indicates that AF-399/40960407 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.47 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/40960407. Following Lipinski's Rule of Five, AF-399/40960407 has 0 hydrogen bond donor(s) and 7 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-399/40960407?
The CAS number of AF-399/40960407 is 433327-67-4.
What is the molecular formula of AF-399/40960407?
The molecular formula of AF-399/40960407 is C20H18FN3O4S.
What is the molecular weight of AF-399/40960407?
The molecular weight of AF-399/40960407 is 415.10 g/mol.
Where can I buy AF-399/40960407?
You can request a quote for AF-399/40960407 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/40960407?
Yes, KEHONG BIO provides custom synthesis services for AF-399/40960407 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.