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5625-89-8

5625-89-8 | 1-(1H-indol-3-yl)-2-morpholin-4-yl-2-oxoethanone

CAS No: 5625-89-8 Catalog No: AG00JD10 MDL No:MFCD00424980

Product Description

Catalog Number:
AG00JD10
Chemical Name:
1-(1H-indol-3-yl)-2-morpholin-4-yl-2-oxoethanone
CAS Number:
5625-89-8
Molecular Formula:
C14H14N2O3
Molecular Weight:
258.2726
MDL Number:
MFCD00424980
IUPAC Name:
1-(1H-indol-3-yl)-2-morpholin-4-ylethane-1,2-dione
InChI:
InChI=1S/C14H14N2O3/c17-13(14(18)16-5-7-19-8-6-16)11-9-15-12-4-2-1-3-10(11)12/h1-4,9,15H,5-8H2
InChI Key:
LMNYZFUEOJRQSR-UHFFFAOYSA-N
SMILES:
O=C(C(=O)c1c[nH]c2c1cccc2)N1CCOCC1

Properties

Complexity:
366  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.1g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
258.277g/mol
Monoisotopic Mass:
258.1g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
62.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  

Literature

Title Journal
Design, synthesis, and structure-activity relationship of indole-3-glyoxylamide libraries possessing highly potent activity in a cell line model of prion disease. Journal of medicinal chemistry 20091210
Synthesis of marine alkaloid: 8,9-dihydrocoscinamide B and its analogues as Novel class of antileishmanial agents. Bioorganic & medicinal chemistry letters 20070715
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

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