F0631-0230
TL;DR: F0631-0230 (CAS 851810-54-3) is a chemical compound with molecular formula C22H21ClFN5OS and molecular weight 457.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[4-(3-chlorophenyl)piperazin-1-yl]-(3-fluorophenyl)methyl]-2-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol
Also Known As: F0631-0230, 5-((4-(3-chlorophenyl)piperazin-1-yl)(3-fluorophenyl)methyl)-2-methylthiazolo[3,2-b][1,2,4]triazol-6-ol, 5-[[4-(3-chlorophenyl)piperazin-1-yl]-(3-fluorophenyl)methyl]-2-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol, 5-{[4-(3-chlorophenyl)piperazin-1-yl](3-fluorophenyl)methyl}-2-methyl-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-ol
| Molecular Formula | C22H21ClFN5OS |
|---|---|
| Molecular Weight | 457.11 g/mol |
| LogP | 4.50892 |
| Topological Polar Surface Area | 56.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 457.11392 |
| Heavy Atoms | 31 |
| Complexity | 1233.8523 |
Chemical Identifiers
| CAS Number | 851810-54-3 |
|---|---|
| SMILES | CC1=NN2C(=C(SC2=N1)C(C3=CC(=CC=C3)F)N4CCN(CC4)C5=CC(=CC=C5)Cl)O |
Product Overview
F0631-0230 (CAS 851810-54-3), with molecular formula C22H21ClFN5OS and molecular weight 457.11 g/mol. IUPAC: 5-[[4-(3-chlorophenyl)piperazin-1-yl]-(3-fluorophenyl)methyl]-2-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol.
Chemical Property Profile of F0631-0230
Property Insights of F0631-0230
The XLogP value of 4.50892 indicates that F0631-0230 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.9 Ų, F0631-0230 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0631-0230 has 1 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 F0631-0230?
The CAS number of F0631-0230 is 851810-54-3.
What is the molecular formula of F0631-0230?
The molecular formula of F0631-0230 is C22H21ClFN5OS.
What is the molecular weight of F0631-0230?
The molecular weight of F0631-0230 is 457.11 g/mol.
Where can I buy F0631-0230?
You can request a quote for F0631-0230 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0631-0230?
Yes, KEHONG BIO provides custom synthesis services for F0631-0230 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.