Ethyl 4-(2-{[(4-fluorophenyl)thio]methyl}-1,3-thiazolan-3-yl)-4-oxobutanoate

Base Information

• Chemical Name: Ethyl 4-(2-{[(4-fluorophenyl)thio]methyl}-1,3-thiazolan-3-yl)-4-oxobutanoate
• CAS No.: 648858-94-0
• Molecular Formula: C16H20FNO3S2
• Molecular Weight: 357.46
• Hs Code.: 2934100090
• DSSTox Substance ID: DTXSID40381643
• Mol file: 648858-94-0.mol

Synonyms:648858-94-0;ethyl 4-(2-{[(4-fluorophenyl)thio]methyl}-1,3-thiazolan-3-yl)-4-oxobutanoate;ethyl 4-[2-[(4-fluorophenyl)sulfanylmethyl]-1,3-thiazolidin-3-yl]-4-oxobutanoate;ETHYL 4-(2-([(4-FLUOROPHENYL)THIO]METHYL)-1,3-THIAZOLAN-3-YL)-4-OXOBUTANOATE;DTXSID40381643

Chemical Property of Ethyl 4-(2-{[(4-fluorophenyl)thio]methyl}-1,3-thiazolan-3-yl)-4-oxobutanoate

Chemical Property:

• PSA: 97.21000
• LogP: 3.10050
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 8
• Exact Mass: 357.08686401
• Heavy Atom Count: 23
• Complexity: 403

Purity/Quality:

ETHYL 4-(2-([(4-FLUOROPHENYL)THIO]METHYL)-1,3-THIAZOLAN-3-YL)-4-OXOBUTANOATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)CCC(=O)N1CCSC1CSC2=CC=C(C=C2)F