CCOC(=O)COc1ccc(C(=O)CN2CCN(C3CCN(C(=O)OC(C)OC(C)=O)CC3)CC2=O)cc1
SMILES: CCOC(=O)COc1ccc(C(=O)CN2CCN(C3CCN(C(=O)OC(C)OC(C)=O)CC3)CC2=O)cc1

Molecular Processing

Molecular formula
C26H35N3O9
Molecular weight
533.58
Exact mass
533.2373
XLogP
1.47
TPSA
131.99
H-bond donors
0
H-bond acceptors
10
Rotatable bonds
10
Heavy atoms
38
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.577
Molar refractivity
133.36

Supplementary Information

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