4785-67-5 | Tetrahydrothiophene-3-carboxylic acid 1,1-dioxide

Packsize	Purity	Availability	Price	Discounted Price
250mg	95%	in stock	$105.00	$74.00
1g	95%	in stock	$235.00	$164.00
5g	95%	in stock	$895.00	$626.00

Description

• Catalog Number: AD24676
• Chemical Name: Tetrahydrothiophene-3-carboxylic acid 1,1-dioxide
• CAS Number: 4785-67-5
• Molecular Formula: C5H8O4S
• Molecular Weight: 164.1796
• MDL Number: MFCD22684985
• SMILES: OC(=O)C1CCS(=O)(=O)C1

Computed Properties

• Complexity: 235
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 10
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 1
• Undefined Atom Stereocenter Count: 1
• XLogP3: -0.7

Literature

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

  Bioorganic & medicinal chemistry letters 20101101