Home Carboxys 1-Ethyl-2-methyl-4-phenyl-1H-pyrrole-3-carboxylic acid

1-Ethyl-2-methyl-4-phenyl-1H-pyrrole-3-carboxylic acid

CAS No.:
293326-22-4
Catalog Number:
AG01A0UZ
Molecular Formula:
Molecular Weight:
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01A0UZ
Chemical Name:
1-Ethyl-2-methyl-4-phenyl-1H-pyrrole-3-carboxylic acid
CAS Number:
293326-22-4
MDL Number:
MFCD00445989
IUPAC Name:
1-ethyl-2-methyl-4-phenylpyrrole-3-carboxylic acid
InChI:
InChI=1S/C14H15NO2/c1-3-15-9-12(11-7-5-4-6-8-11)13(10(15)2)14(16)17/h4-9H,3H2,1-2H3,(H,16,17)
InChI Key:
KGASOPILNXWTPW-UHFFFAOYSA-N
Properties
Complexity:
273  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.11g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
229.279g/mol
Monoisotopic Mass:
229.11g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Literature
Title Journal
Discovery of the 2-phenyl-4,5,6,7-Tetrahydro-1H-indole as a novel anti-hepatitis C virus targeting scaffold. European journal of medicinal chemistry 20150101
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties