COC(=O)C(Cc1ccnc(C(F)(F)F)c1)C(=O)OC(C)(C)C
SMILES: COC(=O)C(Cc1ccnc(C(F)(F)F)c1)C(=O)OC(C)(C)C

Molecular Processing

Molecular formula
C15H18F3NO4
Molecular weight
333.31
Exact mass
333.1188
XLogP
2.77
TPSA
65.49
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
23
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.533
Molar refractivity
74.29

Supplementary Information

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