Cc1ccc(-c2cc(C(=O)NCc3ccc(C)nc3)cc(C(=O)N3C[C@H]4CNC[C@H]4C3)c2)cc1
SMILES: Cc1ccc(-c2cc(C(=O)NCc3ccc(C)nc3)cc(C(=O)N3C[C@H]4CNC[C@H]4C3)c2)cc1

Molecular Processing

Molecular formula
C28H30N4O2
Molecular weight
454.57
Exact mass
454.2369
XLogP
3.59
TPSA
74.33
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
34
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.321
Molar refractivity
132.51

Supplementary Information

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