Nombre: 7-(2-(methylamino)phenyl)-2-(4-phenoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
SMILES:
CNc1ccccc1-c1ccnc2c(C#N)c(-c3ccc(Oc4ccccc4)cc3)nn12Molecular Processing
Molecular formula
C26H19N5O
Molecular weight
417.47
Exact mass
417.159
XLogP
5.77
TPSA
75.24
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
32
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.038
Molar refractivity
124.64
Supplementary Information
Obteniendo detalles…
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