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88164-51-6

88164-51-6 | 1H-Pyrazol-3-amine, 4,5-dihydro-1-(5-quinolinyl)-

CAS No: 88164-51-6 Catalog No: AG004DD2 MDL No:

Product Description

Catalog Number:
AG004DD2
Chemical Name:
1H-Pyrazol-3-amine, 4,5-dihydro-1-(5-quinolinyl)-
CAS Number:
88164-51-6
Molecular Formula:
C12H12N4
Molecular Weight:
212.2505
IUPAC Name:
2-quinolin-5-yl-3,4-dihydropyrazol-5-amine
InChI:
InChI=1S/C12H12N4/c13-12-6-8-16(15-12)11-5-1-4-10-9(11)3-2-7-14-10/h1-5,7H,6,8H2,(H2,13,15)
InChI Key:
ZGFKRXZFGLLVRI-UHFFFAOYSA-N
SMILES:
NC1=NN(CC1)c1cccc2c1cccn2

Properties

Complexity:
289  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.106g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
212.256g/mol
Monoisotopic Mass:
212.106g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

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