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N-(4-ethylphenyl)-2-[3-oxo-1-(phenylcarbamothioyl)piperazin-2-yl]acetamide structure
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N-(4-ethylphenyl)-2-[3-oxo-1-(phenylcarbamothioyl)piperazin-2-yl]acetamide

TL;DR: N-(4-ethylphenyl)-2-[3-oxo-1-(phenylcarbamothioyl)piperazin-2-yl]acetamide (CAS 1008924-61-5) is a chemical compound with molecular formula C21H24N4O2S and molecular weight 396.162 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-(4-ethylphenyl)-2-[3-oxo-1-(phenylcarbamothioyl)piperazin-2-yl]acetamide

Also Known As: N-(4-ethylphenyl)-2-[3-oxo-1-(phenylcarbamothioyl)piperazin-2-yl]acetamide, N-(4-ethylphenyl)-2-(3-oxo-1-(phenylcarbamothioyl)piperazin-2-yl)acetamide, N-(4-Ethyl-phenyl)-2-(3-oxo-1-phenylthiocarbamoyl-piperazin-2-yl)-acetamide, N-(4-ethylphenyl)-2-{3-oxo-1-[(phenylamino)thioxomethyl]piperazin-2-yl}acetami de

CAS Number
1008924-61-5
Molecular Formula
C21H24N4O2S
Molecular Weight
396.162 g/mol
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Technical Specifications

Molecular FormulaC21H24N4O2S
Molecular Weight396.162 g/mol
XLogP2.5
Topological Polar Surface Area (TPSA)106.0 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors3
Rotatable Bonds5
Exact Mass396.162 Da
Heavy Atoms28
Complexity557.0
SMILESCCC1=CC=C(C=C1)NC(=O)CC2C(=O)NCCN2C(=S)NC3=CC=CC=C3
InChIKeyGGKVIUFFDYCIIY-UHFFFAOYSA-N

Chemical Property Profile of N-(4-ethylphenyl)-2-[3-oxo-1-(phenylcarbamothioyl)piperazin-2-yl]acetamide

XLogP
2.5
TPSA (Topological Polar Surface Area)
106.0
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
3
Rotatable Bonds
5
Heavy Atoms
28
Complexity
557.0
Exact Mass
396.162
Monoisotopic Mass
396.162
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 N-(4-ethylphenyl)-2-[3-oxo-1-(phenylcarbamothioyl)piperazin-2-yl]acetamide

The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-ethylphenyl)-2-[3-oxo-1-(phenylcarbamothioyl)piperazin-2-yl]acetamide. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-ethylphenyl)-2-[3-oxo-1-(phenylcarbamothioyl)piperazin-2-yl]acetamide. Following Lipinski's Rule of Five, N-(4-ethylphenyl)-2-[3-oxo-1-(phenylcarbamothioyl)piperazin-2-yl]acetamide has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of N-(4-ethylphenyl)-2-[3-oxo-1-(phenylcarbamothioyl)piperazin-2-yl]acetamide?

The CAS number of N-(4-ethylphenyl)-2-[3-oxo-1-(phenylcarbamothioyl)piperazin-2-yl]acetamide is 1008924-61-5.

What is the molecular formula of N-(4-ethylphenyl)-2-[3-oxo-1-(phenylcarbamothioyl)piperazin-2-yl]acetamide?

The molecular formula of N-(4-ethylphenyl)-2-[3-oxo-1-(phenylcarbamothioyl)piperazin-2-yl]acetamide is C21H24N4O2S.

What is the molecular weight of N-(4-ethylphenyl)-2-[3-oxo-1-(phenylcarbamothioyl)piperazin-2-yl]acetamide?

The molecular weight of N-(4-ethylphenyl)-2-[3-oxo-1-(phenylcarbamothioyl)piperazin-2-yl]acetamide is 396.162 g/mol.

Where can I buy N-(4-ethylphenyl)-2-[3-oxo-1-(phenylcarbamothioyl)piperazin-2-yl]acetamide?

You can request a quote for N-(4-ethylphenyl)-2-[3-oxo-1-(phenylcarbamothioyl)piperazin-2-yl]acetamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for N-(4-ethylphenyl)-2-[3-oxo-1-(phenylcarbamothioyl)piperazin-2-yl]acetamide?

Yes, CoreyChem provides custom synthesis services for N-(4-ethylphenyl)-2-[3-oxo-1-(phenylcarbamothioyl)piperazin-2-yl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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