1138549-36-6 | CX-5461

Packsize	Purity	Availability	Price	Discounted Price
1mg	95%	in stock	$28.00	$19.00
5mg	95%	in stock	$58.00	$40.00
10mg	95%	in stock	$82.00	$57.00
50mg	95%	in stock	$218.00	$152.00
100mg	95%	in stock	$299.00	$209.00
250mg	95%	in stock	$542.00	$380.00
1g	95%	in stock	$1,490.00	$1,043.00

Description

• Catalog Number: AE11176
• Chemical Name: CX-5461
• CAS Number: 1138549-36-6
• Molecular Formula: C27H27N7O2S
• Molecular Weight: 513.614
• MDL Number: MFCD21609261
• SMILES: CN1CCCN(CC1)c1ccc2c(n1)n1c(c(c2=O)C(=O)NCc2cnc(cn2)C)sc2c1cccc2

Computed Properties

• Complexity: 915
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 37
• Hydrogen Bond Acceptor Count: 9
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 4
• XLogP3: 3.3

Upstream Synthesis Route

The compound 2-(Hexahydro-4-methyl-1H-1,4-diazepin-1-yl)-N-[(5-methyl-2-pyrazinyl)methyl]-5-oxo-5H-benzothiazolo[3,2-a][1,8]naphthyridine-6-carboxamide, hereafter referred to as $name$, is utilized in chemical synthesis as a versatile building block. Its unique structure containing a diazepine ring, a benzothiazole moiety, and a naphthyridine core offers a wide range of reactivity and functional group compatibility. $name$ can act as a key intermediate in the synthesis of complex molecules, enabling the introduction of multiple functional groups and stereochemical elements. In organic synthesis, $name$ serves as a valuable scaffold for creating novel compounds with potential applications in medicinal chemistry, materials science, and other interdisciplinary fields.