SMILES:
CC(C)(C)C(=O)Oc1c(-c2c(F)ccc(F)c2Cl)c(=O)[nH]c2nccnc12Molecular Processing
Molecular formula
C18H14ClF2N3O3
Molecular weight
393.78
Exact mass
393.0692
XLogP
3.87
TPSA
84.94
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
27
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
95.61
Supplementary Information
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