SMILES:
COc1cc(NCCCCCCN2C(=O)c3ccccc3C2=O)c2nccc(C)c2c1Molecular Processing
Molecular formula
C25H27N3O3
Molecular weight
417.51
Exact mass
417.2052
XLogP
4.82
TPSA
71.53
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
9
Heavy atoms
31
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.32
Molar refractivity
121.8
Supplementary Information
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