454-05-7 | 3'-Trifluoromethylacetophenone semicarbazone

Packsize	Purity	Availability	Price	Discounted Price
1g	98%	in stock	$139.00	$97.00
5g	98%	in stock	$299.00	$209.00
25g	98%	in stock	$760.00	$532.00

Description

• Catalog Number: AI50636
• Chemical Name: 3'-Trifluoromethylacetophenone semicarbazone
• CAS Number: 454-05-7
• Molecular Formula: C10H10F3N3O
• Molecular Weight: 245.2011
• MDL Number: MFCD17588465
• SMILES: NC(=O)N/N=C(/c1cccc(c1)C(F)(F)F)C

Computed Properties

• Complexity: 314
• Covalently-Bonded Unit Count: 1
• Defined Bond Stereocenter Count: 1
• Heavy Atom Count: 17
• Hydrogen Bond Acceptor Count: 5
• Hydrogen Bond Donor Count: 2
• Rotatable Bond Count: 2
• XLogP3: 1.7

Literature

• Synthesis and structure-activity relationship study of potent trypanocidal thio semicarbazone inhibitors of the trypanosomal cysteine protease cruzain.

  Journal of medicinal chemistry 20020620