Methyl (3-oxo-1-{[3-(trifluoromethyl)phenyl]carbamothioyl}piperazin-2-yl)acetate

Base Information

• Chemical Name: Methyl (3-oxo-1-{[3-(trifluoromethyl)phenyl]carbamothioyl}piperazin-2-yl)acetate
• CAS No.: 4903-83-7
• Molecular Formula: C15H16F3N3O3S
• Molecular Weight: 375.4
• DSSTox Substance ID: DTXSID10387975
• ChEMBL ID: CHEMBL1563049
• Mol file: 4903-83-7.mol

Synonyms:methyl (3-oxo-1-{[3-(trifluoromethyl)phenyl]carbamothioyl}piperazin-2-yl)acetate;1007962-47-1;4903-83-7;AGN-PC-0KB4MA;MLS000663585;CHEMBL1563049;DTXSID10387975;HMS2692H03;STK202877;AKOS002234566;AKOS016301707;SMR000294126;SR-01000276362;SR-01000276362-1;methyl [3-oxo-1-({[3-(trifluoromethyl)phenyl]amino}carbonothioyl)-2-piperazinyl]acetate;methyl 2-(3-oxo-1-{[3-(trifluoromethyl)anilino]carbothioyl}-2-piperazinyl)acetate

Chemical Property of Methyl (3-oxo-1-{[3-(trifluoromethyl)phenyl]carbamothioyl}piperazin-2-yl)acetate

Chemical Property:

• XLogP3: 1.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 4
• Exact Mass: 375.08644704
• Heavy Atom Count: 25
• Complexity: 530

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC(=O)CC1C(=O)NCCN1C(=S)NC2=CC=CC(=C2)C(F)(F)F