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824968-55-0

824968-55-0 | 1H-Pyrazolo[4,3-c]isoquinoline, 9-fluoro-3-methyl-5-phenyl-

CAS No: 824968-55-0 Catalog No: AG004ZG1 MDL No:

Product Description

Catalog Number:
AG004ZG1
Chemical Name:
1H-Pyrazolo[4,3-c]isoquinoline, 9-fluoro-3-methyl-5-phenyl-
CAS Number:
824968-55-0
Molecular Formula:
C17H12FN3
Molecular Weight:
277.2957
IUPAC Name:
9-fluoro-3-methyl-5-phenyl-2H-pyrazolo[4,3-c]isoquinoline
InChI:
InChI=1S/C17H12FN3/c1-10-15-17(21-20-10)14-12(8-5-9-13(14)18)16(19-15)11-6-3-2-4-7-11/h2-9H,1H3,(H,20,21)
InChI Key:
SVXSLJSUDVAURR-UHFFFAOYSA-N
SMILES:
Cc1n[nH]c2c1nc(c1ccccc1)c1c2c(F)ccc1

Properties

Complexity:
371  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.102g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
277.302g/mol
Monoisotopic Mass:
277.102g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  

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