COc1ccc(CNC(=O)N2CCC[C@H]2C(=O)N2CCC[C@H]2C(O)COc2ccc(OC)cc2)cc1
SMILES: COc1ccc(CNC(=O)N2CCC[C@H]2C(=O)N2CCC[C@H]2C(O)COc2ccc(OC)cc2)cc1

Molecular Processing

Molecular formula
C27H35N3O6
Molecular weight
497.59
Exact mass
497.2526
XLogP
2.81
TPSA
100.57
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
36
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
3
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.481
Molar refractivity
134.19

Supplementary Information

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