CN(C)C(=O)c1cc(C2CCCN2c2cc(F)cc(C#N)c2)c2oc(N3CCOCC3)cc(=O)c2c1
SMILES: CN(C)C(=O)c1cc(C2CCCN2c2cc(F)cc(C#N)c2)c2oc(N3CCOCC3)cc(=O)c2c1

Molecular Processing

Molecular formula
C27H27FN4O4
Molecular weight
490.54
Exact mass
490.2016
XLogP
3.68
TPSA
90.02
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
36
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.37
Molar refractivity
133.97

Supplementary Information

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