COc1ccc(Cl)cc1C1(F)C(=O)N(C(=O)NC(C)(C)C(=O)OC(C)(C)C)c2cc(C(F)(F)F)ccc21
SMILES: COc1ccc(Cl)cc1C1(F)C(=O)N(C(=O)NC(C)(C)C(=O)OC(C)(C)C)c2cc(C(F)(F)F)ccc21

Molecular Processing

Molecular formula
C25H25ClF4N2O5
Molecular weight
544.93
Exact mass
544.1388
XLogP
5.76
TPSA
84.94
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
37
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
127.28

Supplementary Information

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