SMILES:
CN(CCO)C1(C(NC(=O)c2cccc(C(F)(F)F)c2Cl)c2ccccc2)CCCC1Molecular Processing
Molecular formula
C23H26ClF3N2O2
Molecular weight
454.92
Exact mass
454.1635
XLogP
5.07
TPSA
52.57
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
7
Heavy atoms
31
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.435
Molar refractivity
114.02
Supplementary Information
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