SMILES:
CCn1cc(CN(C)C(=O)/C=C/c2ccc(N)nc2)c2ccccc21Molecular Processing
Molecular formula
C20H22N4O
Molecular weight
334.42
Exact mass
334.1794
XLogP
3.31
TPSA
64.15
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
25
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
101.77
Supplementary Information
Récupération des détails…
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