SMILES:
Cc1ccc(-c2cc(C#N)c(Cl)nc2-c2ccccc2)cc1Molecular Processing
Molecular formula
C19H13ClN2
Molecular weight
304.78
Exact mass
304.0767
XLogP
5.25
TPSA
36.68
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
22
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.053
Molar refractivity
89.57
Supplementary Information
Récupération des détails…
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