4100-13-4 | 1,2,3-Thiadiazole-4-carboxylic acid

Packsize	Purity	Availability	Price	Discounted Price
100mg	98%	in stock	$12.00	$9.00
1g	95%	in stock	$21.00	$15.00
2g	95%	in stock	$42.00	$29.00
5g	95%	in stock	$89.00	$63.00

Description

• Catalog Number: AB57001
• Chemical Name: 1,2,3-Thiadiazole-4-carboxylic acid
• CAS Number: 4100-13-4
• Molecular Formula: C3H2N2O2S
• Molecular Weight: 130.1252
• MDL Number: MFCD00052099
• SMILES: OC(=O)c1csnn1
• NSC Number: 521674

Computed Properties

• Complexity: 108
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 8
• Hydrogen Bond Acceptor Count: 5
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 1
• XLogP3: 0.3

Literature

• Agonist lead identification for the high affinity niacin receptor GPR109a.

  Bioorganic & medicinal chemistry letters 20070901

• Attempted reduction of 1,2,3-thiadiazole-4-carboxylates with samarium/iodine in methanol. Unexpected ring enlargement to 1,2,5-trithiepan-4,6-dicarboxylates.

  Organic & biomolecular chemistry 20041007