O=C(O)Cc1nn(Cc2ccc(NC(=O)c3ccc4cc(F)ccc4c3)cc2)c2ccccc12
SMILES: O=C(O)Cc1nn(Cc2ccc(NC(=O)c3ccc4cc(F)ccc4c3)cc2)c2ccccc12

Molecular Processing

Molecular formula
C27H20FN3O3
Molecular weight
453.47
Exact mass
453.1489
XLogP
5.26
TPSA
84.22
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
34
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.074
Molar refractivity
128.48

Supplementary Information

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