5442-91-1 | 4-(Ethoxycarbonyl)-3,5-dimethyl-1h-pyrrole-2-carboxylic acid

Packsize	Purity	Availability	Price	Discounted Price
1g	98%	in stock	$28.00	$19.00
5g	98%	in stock	$96.00	$67.00
10g	98%	in stock	$165.00	$115.00
25g	98%	in stock	$349.00	$244.00
100g	98%	in stock	$956.00	$669.00

Description

• Catalog Number: AG24293
• Chemical Name: 4-(Ethoxycarbonyl)-3,5-dimethyl-1h-pyrrole-2-carboxylic acid
• CAS Number: 5442-91-1
• Molecular Formula: C10H13NO4
• Molecular Weight: 211.2145
• MDL Number: MFCD00030408
• SMILES: CCOC(=O)c1c(C)[nH]c(c1C)C(=O)O
• NSC Number: 13427

Computed Properties

• Complexity: 266
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 15
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 2
• Rotatable Bond Count: 4
• XLogP3: 1.6

Literature

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

  Bioorganic & medicinal chemistry letters 20101101

• Microsphere-based protease assays and screening application for lethal factor and factor Xa.

  Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501