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Home Other Building Blocks 2-(1H-Indol-3-yl)-4-oxo-4-phenylbutanoic acid

2-(1H-Indol-3-yl)-4-oxo-4-phenylbutanoic acid

CAS No.:
6266-66-6
Catalog Number:
AG00EATK
Molecular Formula:
C18H15NO3
Molecular Weight:
293.3166
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
10mg
99%
1 week
United States
$126
- +
50mg
99%
1 week
United States
$182
- +
Product Description
Catalog Number:
AG00EATK
Chemical Name:
2-(1H-Indol-3-yl)-4-oxo-4-phenylbutanoic acid
CAS Number:
6266-66-6
Molecular Formula:
C18H15NO3
Molecular Weight:
293.3166
MDL Number:
MFCD00170195
IUPAC Name:
2-(1H-indol-3-yl)-4-oxo-4-phenylbutanoic acid
InChI:
InChI=1S/C18H15NO3/c20-17(12-6-2-1-3-7-12)10-14(18(21)22)15-11-19-16-9-5-4-8-13(15)16/h1-9,11,14,19H,10H2,(H,21,22)
InChI Key:
SJVMWLJNHPHNPT-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)CC(c1c[nH]c2c1cccc2)C(=O)O
NSC Number:
36840
Properties
Complexity:
417  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.105g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
293.322g/mol
Monoisotopic Mass:
293.105g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
70.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Literature
Title Journal
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
Properties