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F0631-0225 structure
Fine Chemical

F0631-0225

TL;DR: F0631-0225 (CAS 851810-49-6) is a chemical compound with molecular formula C22H22FN5OS and molecular weight 423.15292 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

5-[(3-fluorophenyl)-(4-phenylpiperazin-1-yl)methyl]-2-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol

Also Known As: F0631-0225, 5-((3-fluorophenyl)(4-phenylpiperazin-1-yl)methyl)-2-methylthiazolo[3,2-b][1,2,4]triazol-6-ol, 5-[(3-fluorophenyl)(4-phenylpiperazin-1-yl)methyl]-2-methyl-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-ol, 5-[(3-fluorophenyl)-(4-phenylpiperazin-1-yl)methyl]-2-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol

CAS Number
851810-49-6
Molecular Formula
C22H22FN5OS
Molecular Weight
423.15292 g/mol
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Technical Specifications

Molecular FormulaC22H22FN5OS
Molecular Weight423.15292 g/mol
XLogP4.5
Topological Polar Surface Area (TPSA)85.1 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors7
Rotatable Bonds4
Exact Mass423.15292 Da
Heavy Atoms30
Complexity574.0
SMILESCC1=NN2C(=C(SC2=N1)C(C3=CC(=CC=C3)F)N4CCN(CC4)C5=CC=CC=C5)O
InChIKeyOBFKQJVSRDZUHO-UHFFFAOYSA-N

Chemical Property Profile of F0631-0225

XLogP
4.5
TPSA (Topological Polar Surface Area)
85.1
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
7
Rotatable Bonds
4
Heavy Atoms
30
Complexity
574.0
Exact Mass
423.15292
Monoisotopic Mass
423.15292
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of F0631-0225

The XLogP value of 4.5 indicates that F0631-0225 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.1 Ų falls within the moderate polarity range, balancing permeability and solubility for F0631-0225. Following Lipinski's Rule of Five, F0631-0225 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of F0631-0225?

The CAS number of F0631-0225 is 851810-49-6.

What is the molecular formula of F0631-0225?

The molecular formula of F0631-0225 is C22H22FN5OS.

What is the molecular weight of F0631-0225?

The molecular weight of F0631-0225 is 423.15292 g/mol.

Where can I buy F0631-0225?

You can request a quote for F0631-0225 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for F0631-0225?

Yes, CoreyChem provides custom synthesis services for F0631-0225 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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