CC(C)CC(C(=O)NNC(=O)CNC(=O)OCc1ccccc1)C(CCCc1ccccc1)C(=O)OC(C)(C)C
SMILES: CC(C)CC(C(=O)NNC(=O)CNC(=O)OCc1ccccc1)C(CCCc1ccccc1)C(=O)OC(C)(C)C

Molecular Processing

Molecular formula
C31H43N3O6
Molecular weight
553.7
Exact mass
553.3152
XLogP
4.7
TPSA
122.83
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
13
Heavy atoms
40
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.484
Molar refractivity
152.58

Supplementary Information

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