2788-73-0 | 1-Ethyl-2-methylbenzodiazole-5-carboxylic acid

Packsize	Purity	Availability	Price	Discounted Price
1g	98%	in stock	$203.00	$142.00
5g	98%	in stock	$573.00	$402.00
10g	98%	in stock	$946.00	$662.00

Description

• Catalog Number: AF36892
• Chemical Name: 1-Ethyl-2-methylbenzodiazole-5-carboxylic acid
• CAS Number: 2788-73-0
• Molecular Formula: C11H12N2O2
• Molecular Weight: 204.2252
• MDL Number: MFCD00656643
• SMILES: CCn1c(C)nc2c1ccc(c2)C(=O)O

Computed Properties

• Complexity: 257
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 15
• Hydrogen Bond Acceptor Count: 3
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 2
• XLogP3: 1.7

Literature

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

  Bioorganic & medicinal chemistry letters 20101101