5878-61-5 | 7-(2-Chloroethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione

Packsize	Purity	Availability	Price	Discounted Price
5g	98%	in stock	$22.00	$16.00
25g	>98.0%(T)(HPLC)	in stock	$89.00	$63.00

Description

• Catalog Number: AB49041
• Chemical Name: 7-(2-Chloroethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
• CAS Number: 5878-61-5
• Molecular Formula: C9H11ClN4O2
• Molecular Weight: 242.6622
• MDL Number: MFCD00005760
• SMILES: ClCCn1cnc2c1c(=O)n(C)c(=O)n2C
• NSC Number: 337614

Computed Properties

• Complexity: 325
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 16
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• XLogP3: 0.1

Literature

• Microsphere-based protease assays and screening application for lethal factor and factor Xa.

  Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

• Synthesis of molecularly imprinted polymer with 7-chloroethyl-theophylline-immobilized silica gel as template and its molecular recognition function.

  Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20040101

• Structure-activity relationships at human and rat A2B adenosine receptors of xanthine derivatives substituted at the 1-, 3-, 7-, and 8-positions.

  Journal of medicinal chemistry 20020523