716358-46-2 | 3-[(Isopropylamino)sulfonyl]benzoic acid

Packsize	Purity	Availability	Price	Discounted Price
1g	98%	in stock	$139.00	$97.00
5g	98%	in stock	$387.00	$271.00
10g	98%	in stock	$667.00	$467.00
25g	98%	in stock	$1,319.00	$923.00

Description

• Catalog Number: AH21588
• Chemical Name: 3-[(Isopropylamino)sulfonyl]benzoic acid
• CAS Number: 716358-46-2
• Molecular Formula: C10H13NO4S
• Molecular Weight: 243.2795
• MDL Number: MFCD05270857
• SMILES: CC(NS(=O)(=O)c1cccc(c1)C(=O)O)C

Computed Properties

• Complexity: 344
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 16
• Hydrogen Bond Acceptor Count: 5
• Hydrogen Bond Donor Count: 2
• Rotatable Bond Count: 4
• XLogP3: 1.2

Literature

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

  Bioorganic & medicinal chemistry letters 20101101