CCC(CC)(c1ccc(Cl)cc1F)c1c[nH]c2c(CSC)cccc12
SMILES: CCC(CC)(c1ccc(Cl)cc1F)c1c[nH]c2c(CSC)cccc12

Molecular Processing

Molecular formula
C21H23ClFNS
Molecular weight
375.94
Exact mass
375.1224
XLogP
6.93
TPSA
15.79
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
6
Heavy atoms
25
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
108.29

Supplementary Information

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