SMILES:
CCNc1nc2cccc(C(=O)OCC)c2n1Cc1ccc(-c2ccccc2C#N)cc1Molecular Processing
Molecular formula
C26H24N4O2
Molecular weight
424.5
Exact mass
424.1899
XLogP
5.23
TPSA
79.94
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
32
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.192
Molar refractivity
125.55
Supplementary Information
Details werden geladen…
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