COc1ccc(Cl)cc1C1(F)C(=O)N(COC(=O)Cc2nnn[nH]2)c2cc(C(F)(F)F)ccc21
SMILES: COc1ccc(Cl)cc1C1(F)C(=O)N(COC(=O)Cc2nnn[nH]2)c2cc(C(F)(F)F)ccc21

Molecular Processing

Molecular formula
C20H14ClF4N5O4
Molecular weight
499.81
Exact mass
499.067
XLogP
3.18
TPSA
110.3
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
34
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
107.66

Supplementary Information

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