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F0561-0445 structure
Fine Chemical

F0561-0445

TL;DR: F0561-0445 (CAS 1007195-24-5) is a chemical compound with molecular formula C18H13ClN4O4S and molecular weight 416.0346 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-[2-(3-chlorophenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-nitrobenzamide

Also Known As: F0561-0445, N-[2-(3-chlorophenyl)-5-oxo-2H,4H,6H-5lambda4-thieno[3,4-c]pyrazol-3-yl]-2-nitrobenzamide, N-[2-(3-chlorophenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-2-nitrobenzamide, N-(2-(3-chlorophenyl)-5-oxido-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)-2-nitrobenzamide

CAS Number
1007195-24-5
Molecular Formula
C18H13ClN4O4S
Molecular Weight
416.0346 g/mol
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Technical Specifications

Molecular FormulaC18H13ClN4O4S
Molecular Weight416.0346 g/mol
XLogP2.3
Topological Polar Surface Area (TPSA)129.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors6
Rotatable Bonds3
Exact Mass416.0346 Da
Heavy Atoms28
Complexity648.0
SMILESC1C2=C(N(N=C2CS1=O)C3=CC(=CC=C3)Cl)NC(=O)C4=CC=CC=C4[N+](=O)[O-]
InChIKeyUIJZMXPXWNLKMC-UHFFFAOYSA-N

Product Description

Applications: Oprea1_833839 is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Oprea1_833839 (CAS 1007195-24-5) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

Oprea1_833839 is a fine chemical identified by CAS number 1007195-24-5 and the molecular formula C18H13ClN4O4S and a molecular weight of 416.03 g/mol. It is also known as SR-01000547128-1 and F0561-0445.

CoreyChem provides it with COA documentation, and custom synthesis from milligram to multi-kilogram scales is available on request. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of F0561-0445

XLogP
2.3
TPSA (Topological Polar Surface Area)
129.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
6
Rotatable Bonds
3
Heavy Atoms
28
Complexity
648.0
Exact Mass
416.0346
Monoisotopic Mass
416.0346
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 F0561-0445

The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0561-0445. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for F0561-0445. Following Lipinski's Rule of Five, F0561-0445 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 F0561-0445?

The CAS number of F0561-0445 is 1007195-24-5.

What is the molecular formula of F0561-0445?

The molecular formula of F0561-0445 is C18H13ClN4O4S.

What is the molecular weight of F0561-0445?

The molecular weight of F0561-0445 is 416.0346 g/mol.

What are the applications of F0561-0445?

Oprea1_833839 is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Oprea1_833839 (CAS 1007195-24-5) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and...

Where can I buy F0561-0445?

You can request a quote for F0561-0445 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for F0561-0445?

Yes, CoreyChem provides custom synthesis services for F0561-0445 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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