SMILES:
O=C1C(N2C(=O)c3ccccc3C2=O)Cc2ccccc2C2CCC=CN12Molecular Processing
Molecular formula
C22H18N2O3
Molecular weight
358.4
Exact mass
358.1317
XLogP
3.08
TPSA
57.69
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
27
Rings
5
Aromatic rings
2
Saturated rings
0
Aliphatic rings
3
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.227
Molar refractivity
98.84
Supplementary Information
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