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37663-42-6

37663-42-6 | 1'-BENZYL-3H-SPIRO[2-BENZOFURAN-1,4'-PIPERIDIN]-3-ONE

CAS No: 37663-42-6 Catalog No: AG0078ED MDL No:MFCD08909181

Product Description

Catalog Number:
AG0078ED
Chemical Name:
1'-BENZYL-3H-SPIRO[2-BENZOFURAN-1,4'-PIPERIDIN]-3-ONE
CAS Number:
37663-42-6
Molecular Formula:
C19H19NO2
Molecular Weight:
293.3597
MDL Number:
MFCD08909181
IUPAC Name:
1'-benzylspiro[2-benzofuran-3,4'-piperidine]-1-one
InChI:
InChI=1S/C19H19NO2/c21-18-16-8-4-5-9-17(16)19(22-18)10-12-20(13-11-19)14-15-6-2-1-3-7-15/h1-9H,10-14H2
InChI Key:
RZXNEAPKBXXMQP-UHFFFAOYSA-N
SMILES:
O=C1OC2(c3c1cccc3)CCN(CC2)Cc1ccccc1

Properties

Complexity:
408  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.142g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
293.366g/mol
Monoisotopic Mass:
293.142g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

Literature

Title Journal
Novel spiropiperidines as highly potent and subtype selective sigma-receptor ligands. Part 1. Journal of medicinal chemistry 20020117

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