CC(C)c1cc(C#N)cc2nc(-c3ccc(C(=O)NCC4CCN(Cc5ccc(Br)cc5)C4)cc3)oc12
SMILES: CC(C)c1cc(C#N)cc2nc(-c3ccc(C(=O)NCC4CCN(Cc5ccc(Br)cc5)C4)cc3)oc12

Molecular Processing

Molecular formula
C30H29BrN4O2
Molecular weight
557.49
Exact mass
556.1474
XLogP
6.5
TPSA
82.16
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
37
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
148.11

Supplementary Information

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Involved in 2 reactions→

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