110221-26-6 | (2S,6R)-6-Amino-2-(2-thienyl)-1,4-thiazepan-5-one

Packsize	Purity	Availability	Price	Discounted Price
100mg	98%	in stock	$37.00	$26.00
250mg	98%	in stock	$80.00	$56.00
1g	98%	in stock	$232.00	$163.00
5g	98%	in stock	$918.00	$642.00

Description

• Catalog Number: AD78557
• Chemical Name: (2S,6R)-6-Amino-2-(2-thienyl)-1,4-thiazepan-5-one
• CAS Number: 110221-26-6
• Molecular Formula: C9H12N2OS2
• Molecular Weight: 228.3344
• MDL Number: MFCD08458730
• SMILES: O=C1NC[C@H](SC[C@@H]1N)c1cccs1

Computed Properties

• Complexity: 225
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 2
• Heavy Atom Count: 14
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 2
• Rotatable Bond Count: 1
• XLogP3: 0.3

Upstream Synthesis Route

The compound (2S,6R)-6-Amino-2-(thiophen-2-yl)-1,4-thiazepan-5-one, often referred to as $name$, serves as a valuable building block in chemical synthesis. With its unique structure and properties, this compound plays a crucial role in various synthetic pathways and reactions. In particular, (2S,6R)-6-Amino-2-(thiophen-2-yl)-1,4-thiazepan-5-one is utilized as a key intermediate in the production of pharmaceuticals, agrochemicals, and fine chemicals. Its presence enables the introduction of the essential amine and thiazepane functionalities into the desired target molecules, leading to the creation of novel compounds with diverse biological activities. Additionally, this compound can participate in a range of transformations, including cross-coupling reactions, cyclization reactions, and functional group manipulations, allowing for the efficient and selective synthesis of complex organic compounds. As a versatile synthetic precursor, (2S,6R)-6-Amino-2-(thiophen-2-yl)-1,4-thiazepan-5-one contributes significantly to the advancement of chemical synthesis and the development of new chemical entities with potential therapeutic applications.