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114746-66-6

114746-66-6 | 1H-Indole, 3-(1-piperazinylmethyl)-

CAS No: 114746-66-6 Catalog No: AG000F5S MDL No:MFCD10698642

Product Description

Catalog Number:
AG000F5S
Chemical Name:
1H-Indole, 3-(1-piperazinylmethyl)-
CAS Number:
114746-66-6
Molecular Formula:
C13H17N3
Molecular Weight:
215.2942
MDL Number:
MFCD10698642
IUPAC Name:
3-(piperazin-1-ylmethyl)-1H-indole
InChI:
InChI=1S/C13H17N3/c1-2-4-13-12(3-1)11(9-15-13)10-16-7-5-14-6-8-16/h1-4,9,14-15H,5-8,10H2
InChI Key:
ZTNAIHGOFCMOPJ-UHFFFAOYSA-N
SMILES:
N1CCN(CC1)Cc1c[nH]c2c1cccc2

Properties

Complexity:
225  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.142g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
215.3g/mol
Monoisotopic Mass:
215.142g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
31.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  

Literature

Title Journal
Reductive amination products containing naphthalene and indole moieties bind to melanocortin receptors. Bioorganic & medicinal chemistry letters 20020408

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