SMILES:
CCN(CCc1cc2cc(-c3ccc(C(=O)N4CCOCC4)cn3)ccc2o1)C(C)CMolecular Processing
Molecular formula
C25H31N3O3
Molecular weight
421.54
Exact mass
421.2365
XLogP
4.24
TPSA
58.81
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
31
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.44
Molar refractivity
122.25
Supplementary Information
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