SMILES:
CN(C(=O)c1ccc(Cl)cc1)C1CCN(C(=O)C2CCN(C(=O)CF)CC2)CC1c1ccc(Cl)c(Cl)c1Molecular Processing
Molecular formula
C27H29Cl3FN3O3
Molecular weight
568.9
Exact mass
567.1259
XLogP
5.31
TPSA
60.93
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
37
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.444
Molar refractivity
143.01
Supplementary Information
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