O=C1CCC(N2Cc3cc(CNC(=O)Nc4ccc(C(F)(F)F)c(Cl)c4)ccc3C2=O)C(=O)N1
SMILES: O=C1CCC(N2Cc3cc(CNC(=O)Nc4ccc(C(F)(F)F)c(Cl)c4)ccc3C2=O)C(=O)N1

Molecular Processing

Molecular formula
C22H18ClF3N4O4
Molecular weight
494.86
Exact mass
494.0969
XLogP
3.44
TPSA
107.61
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
34
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
114.8

Supplementary Information

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