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33357-47-0

33357-47-0 | N-(1-Isoquinolinyl)benzamide

CAS No: 33357-47-0 Catalog No: AG00D16S MDL No:

Product Description

Catalog Number:
AG00D16S
Chemical Name:
N-(1-Isoquinolinyl)benzamide
CAS Number:
33357-47-0
IUPAC Name:
N-isoquinolin-1-ylbenzamide
InChI:
InChI=1S/C16H12N2O/c19-16(13-7-2-1-3-8-13)18-15-14-9-5-4-6-12(14)10-11-17-15/h1-11H,(H,17,18,19)
InChI Key:
OMLUWEHKCFFWOP-UHFFFAOYSA-N

Properties

Complexity:
312  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.095g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
248.285g/mol
Monoisotopic Mass:
248.095g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  

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