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F0631-0043 structure
Fine Chemical

F0631-0043

TL;DR: F0631-0043 (CAS 162661-16-7) is a chemical compound with molecular formula C18H23N5OS and molecular weight 357.16232 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

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

Also Known As: F0631-0043, 2-methyl-5-((4-methylpiperazin-1-yl)(p-tolyl)methyl)thiazolo[3,2-b][1,2,4]triazol-6-ol, 2-methyl-5-[(4-methylphenyl)-(4-methylpiperazin-1-yl)methyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol, 2-methyl-5-[(4-methylphenyl)(4-methylpiperazin-1-yl)methyl]-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-ol

CAS Number
162661-16-7
Molecular Formula
C18H23N5OS
Molecular Weight
357.16232 g/mol
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Technical Specifications

Molecular FormulaC18H23N5OS
Molecular Weight357.16232 g/mol
XLogP3.0
Topological Polar Surface Area (TPSA)85.1 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors6
Rotatable Bonds3
Exact Mass357.16232 Da
Heavy Atoms25
Complexity453.0
SMILESCC1=CC=C(C=C1)C(C2=C(N3C(=NC(=N3)C)S2)O)N4CCN(CC4)C
InChIKeyIXCNBQPSPJNLEH-UHFFFAOYSA-N

Chemical Property Profile of F0631-0043

XLogP
3.0
TPSA (Topological Polar Surface Area)
85.1
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
6
Rotatable Bonds
3
Heavy Atoms
25
Complexity
453.0
Exact Mass
357.16232
Monoisotopic Mass
357.16232
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 F0631-0043

The XLogP value of 3.0 indicates that F0631-0043 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 F0631-0043. Following Lipinski's Rule of Five, F0631-0043 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

What is the CAS number of F0631-0043?

The CAS number of F0631-0043 is 162661-16-7.

What is the molecular formula of F0631-0043?

The molecular formula of F0631-0043 is C18H23N5OS.

What is the molecular weight of F0631-0043?

The molecular weight of F0631-0043 is 357.16232 g/mol.

Where can I buy F0631-0043?

You can request a quote for F0631-0043 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for F0631-0043?

Yes, CoreyChem provides custom synthesis services for F0631-0043 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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