SMILES:
CC(C)N1CCC(Oc2cc3cc(C(=O)N4CCOCC4)n(-c4ccnc(Cl)c4)c3cc2Br)CC1Molecular Processing
Molecular formula
C26H30BrClN4O3
Molecular weight
561.91
Exact mass
560.119
XLogP
5.17
TPSA
59.83
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
35
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
140.86
Supplementary Information
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Involved in 6 reactions→