19156-54-8 | 4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid

Packsize	Purity	Availability	Price	Discounted Price
250mg	95%	in stock	$9.00	$7.00
1g	95%	in stock	$19.00	$14.00
5g	95%	in stock	$80.00	$56.00
10g	95%	in stock	$122.00	$85.00

Description

• Catalog Number: AB12973
• Chemical Name: 4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid
• CAS Number: 19156-54-8
• Molecular Formula: C9H10O2S
• Molecular Weight: 182.2395
• MDL Number: MFCD00652575
• SMILES: OC(=O)c1csc2c1CCCC2

Computed Properties

• Complexity: 193
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 12
• Hydrogen Bond Acceptor Count: 3
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 1
• XLogP3: 2.4

Literature

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

  Bioorganic & medicinal chemistry letters 20101101