CCCOc1c(OC)cc(CCl)cc1SC
SMILES: CCCOc1c(OC)cc(CCl)cc1SC

Molecular Processing

Molecular formula
C12H17ClO2S
Molecular weight
260.79
Exact mass
260.0638
XLogP
3.94
TPSA
18.46
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
16
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
70.12

Supplementary Information

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