878218-25-8 | 1-(4-Cyanophenyl)-N-isopropylmethanesulfonamide

Packsize	Purity	Availability	Price	Discounted Price
1g	98%	in stock	$249.00	$175.00
5g	98%	in stock	$690.00	$483.00
10g	98%	in stock	$1,019.00	$714.00

Description

• Catalog Number: AI58777
• Chemical Name: 1-(4-Cyanophenyl)-N-isopropylmethanesulfonamide
• CAS Number: 878218-25-8
• Molecular Formula: C11H14N2O2S
• Molecular Weight: 238.3061
• MDL Number: MFCD08239623
• SMILES: CC(NS(=O)(=O)Cc1ccc(cc1)C#N)C

Computed Properties

• Complexity: 353
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 16
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 4
• XLogP3: 1.3

Literature

• Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

  Bioorganic & medicinal chemistry letters 20101101