ethyl 4-{(2Z)-3-(3,4-dimethoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}piperazine-1-carboxylate

Base Information

• Chemical Name: ethyl 4-{(2Z)-3-(3,4-dimethoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}piperazine-1-carboxylate
• CAS No.: 5907-54-0
• Molecular Formula: C25H29N3O6
• Molecular Weight: 467.5143
• DSSTox Substance ID: DTXSID50417220
• Wikidata: Q82226973
• ChEMBL ID: CHEMBL1334422

Synonyms:5907-54-0;BAS 01217449;MLS000712125;CHEMBL1334422;DTXSID50417220;HMS2648K18;STK834443;AKOS000511537;SMR000281892;BIM-0036391.P001;ethyl 4-{(2Z)-3-(3,4-dimethoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}piperazine-1-carboxylate

Chemical Property of ethyl 4-{(2Z)-3-(3,4-dimethoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}piperazine-1-carboxylate

Chemical Property:

• Vapor Pressure: 1.84E-20mmHg at 25°C
• Boiling Point: 717.9°Cat760mmHg
• Flash Point: 388°C
• Density: 1.245g/cm³
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 8
• Exact Mass: 467.20563565
• Heavy Atom Count: 34
• Complexity: 728

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)N1CCN(CC1)C(=O)C(=CC2=CC(=C(C=C2)OC)OC)NC(=O)C3=CC=CC=C3
• Isomeric SMILES: CCOC(=O)N1CCN(CC1)C(=O)/C(=C/C2=CC(=C(C=C2)OC)OC)/NC(=O)C3=CC=CC=C3

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