Name: 2-amino-2-methyl-3-(5-chloro-7-methyl-2H-indazol-2-yl)propionitrile
SMILES:
Cc1cc(Cl)cc2cn(CC(C)(N)C#N)nc12Molecular Processing
Molecular formula
C12H13ClN4
Molecular weight
248.72
Exact mass
248.0829
XLogP
2.24
TPSA
67.63
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
67.69
Supplementary Information
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