36242-50-9 | Methyl 4-(methylamino)-3-nitrobenzoate

Packsize	Purity	Availability	Price	Discounted Price
250mg	97%	in stock	$18.00	$12.00
1g	97%	in stock	$32.00	$22.00
5g	97%	in stock	$65.00	$45.00
10g	97%	in stock	$90.00	$63.00
25g	97%	in stock	$201.00	$141.00
100g	97%	in stock	$757.00	$530.00

Description

• Catalog Number: AF84034
• Chemical Name: Methyl 4-(methylamino)-3-nitrobenzoate
• CAS Number: 36242-50-9
• Molecular Formula: C9H10N2O4
• Molecular Weight: 210.1867
• MDL Number: MFCD09862450
• SMILES: COC(=O)c1ccc(c(c1)[N+](=O)[O-])NC

Computed Properties

• Complexity: 251
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 15
• Hydrogen Bond Acceptor Count: 5
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 3
• XLogP3: 2.1

Literature

• Ligand based virtual screening and biological evaluation of inhibitors of chorismate mutase (Rv1885c) from Mycobacterium tuberculosis H37Rv.

  Bioorganic & medicinal chemistry letters 20070601