SMILES:
CC1CCN(CCOc2ccc(NC(=O)C#Cc3ccc(C(F)(F)F)cc3Cl)cc2Cl)CC1Molecular Processing
Molecular formula
C24H23Cl2F3N2O2
Molecular weight
499.36
Exact mass
498.1089
XLogP
6.11
TPSA
41.57
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
33
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
123.75
Supplementary Information
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