(E)-(3-chlorobenzo[b]thiophen-2-yl)(4-cinnamylpiperazin-1-yl)methanone

Base Information

• Chemical Name: (E)-(3-chlorobenzo[b]thiophen-2-yl)(4-cinnamylpiperazin-1-yl)methanone
• CAS No.: 5917-31-7
• Molecular Formula: C22H21ClN2OS
• Molecular Weight: 396.9329
• DSSTox Substance ID: DTXSID50362024
• Wikidata: Q82144721

Synonyms:324779-80-8;(E)-(3-chlorobenzo[b]thiophen-2-yl)(4-cinnamylpiperazin-1-yl)methanone;1-(3-CHLORO-1-BENZOTHIOPHENE-2-CARBONYL)-4-[(2E)-3-PHENYLPROP-2-EN-1-YL]PIPERAZINE;5917-31-7;AC1LQS3E;Oprea1_051667;DTXSID50362024;STK840412;AKOS000811507;BIM-0037340.P001;SR-01000442346;SR-01000442346-1;F0442-0014;(3-chloro-1-benzothiophen-2-yl){4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}methanone

Chemical Property of (E)-(3-chlorobenzo[b]thiophen-2-yl)(4-cinnamylpiperazin-1-yl)methanone

Chemical Property:

• Vapor Pressure: 3.91E-14mmHg at 25°C
• Boiling Point: 595.2°Cat760mmHg
• Flash Point: 313.8°C
• Density: 1.29g/cm³
• XLogP3: 5.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 396.1063122
• Heavy Atom Count: 27
• Complexity: 528

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CCN1CC=CC2=CC=CC=C2)C(=O)C3=C(C4=CC=CC=C4S3)Cl
• Isomeric SMILES: C1CN(CCN1C/C=C/C2=CC=CC=C2)C(=O)C3=C(C4=CC=CC=C4S3)Cl

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