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87582-33-0

87582-33-0 | Methanone,1H-indol-3-yl(2-phenyldiazenyl)-, 2-phenylhydrazone

CAS No: 87582-33-0 Catalog No: AG004MBV MDL No:

Product Description

Catalog Number:
AG004MBV
Chemical Name:
Methanone,1H-indol-3-yl(2-phenyldiazenyl)-, 2-phenylhydrazone
CAS Number:
87582-33-0
Molecular Formula:
C21H17N5
Molecular Weight:
339.3932
IUPAC Name:
N'-anilino-N-phenylimino-1H-indole-3-carboximidamide
InChI:
InChI=1S/C21H17N5/c1-3-9-16(10-4-1)23-25-21(26-24-17-11-5-2-6-12-17)19-15-22-20-14-8-7-13-18(19)20/h1-15,22-23H
InChI Key:
PLXLITZUXZPTFP-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)NN=C(c1c[nH]c2c1cccc2)N=Nc1ccccc1

Properties

Complexity:
491  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.148g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
339.402g/mol
Monoisotopic Mass:
339.148g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
5.9  

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