CC(Cc1ccc2c(c1)OC(C(=O)OC(C)C)(C(=O)OC(C)C)O2)NCC(O)c1cccc(Cl)c1
SMILES: CC(Cc1ccc2c(c1)OC(C(=O)OC(C)C)(C(=O)OC(C)C)O2)NCC(O)c1cccc(Cl)c1

Molecular Processing

Molecular formula
C26H32ClNO7
Molecular weight
506
Exact mass
505.1867
XLogP
3.96
TPSA
103.32
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
10
Heavy atoms
35
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
130.47

Supplementary Information

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