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332357-73-0

332357-73-0 | 1-(3,4-Dihydro-2H-quinolin-1-yl)-2-(5-o-tolyl-[1,3,4]oxadiazol-2-ylsulfanyl)-ethanone

CAS No: 332357-73-0 Catalog No: AG01EV8C MDL No:

Product Description

Catalog Number:
AG01EV8C
Chemical Name:
1-(3,4-Dihydro-2H-quinolin-1-yl)-2-(5-o-tolyl-[1,3,4]oxadiazol-2-ylsulfanyl)-ethanone
CAS Number:
332357-73-0
Molecular Formula:
C20H19N3O2S
Molecular Weight:
365.4488
IUPAC Name:
1-(3,4-dihydro-2H-quinolin-1-yl)-2-[[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone
InChI:
InChI=1S/C20H19N3O2S/c1-14-7-2-4-10-16(14)19-21-22-20(25-19)26-13-18(24)23-12-6-9-15-8-3-5-11-17(15)23/h2-5,7-8,10-11H,6,9,12-13H2,1H3
InChI Key:
ZMGMJJBAKPXXLZ-UHFFFAOYSA-N
SMILES:
Cc1ccccc1c1nnc(o1)SCC(=O)N1CCCc2c1cccc2

Properties

Complexity:
492  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
365.12g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
365.451g/mol
Monoisotopic Mass:
365.12g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
84.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  

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