Home Other Building Blocks 1-[(1-phenyl-1H-pyrazol-4-yl)methyl]-1H-pyrazol-5-amine

1-[(1-phenyl-1H-pyrazol-4-yl)methyl]-1H-pyrazol-5-amine

CAS No.:
1052554-89-8
Catalog Number:
AG01A316
Molecular Formula:
C13H13N5
Molecular Weight:
239.2758
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Product Description
Catalog Number:
AG01A316
Chemical Name:
1-[(1-phenyl-1H-pyrazol-4-yl)methyl]-1H-pyrazol-5-amine
CAS Number:
1052554-89-8
Molecular Formula:
C13H13N5
Molecular Weight:
239.2758
MDL Number:
MFCD09737207
IUPAC Name:
2-[(1-phenylpyrazol-4-yl)methyl]pyrazol-3-amine
InChI:
InChI=1S/C13H13N5/c14-13-6-7-15-18(13)10-11-8-16-17(9-11)12-4-2-1-3-5-12/h1-9H,10,14H2
InChI Key:
NBYBFRKEXZXWEK-UHFFFAOYSA-N
SMILES:
Nc1ccnn1Cc1cnn(c1)c1ccccc1
Properties
Complexity:
266  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.117g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
239.282g/mol
Monoisotopic Mass:
239.117g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
61.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties