ClCCCn1cc2ccc(-c3ccsc3)cc2n1
SMILES: ClCCCn1cc2ccc(-c3ccsc3)cc2n1

Molecular Processing

Molecular formula
C14H13ClN2S
Molecular weight
276.79
Exact mass
276.0488
XLogP
4.39
TPSA
17.82
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
18
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
0.214
Molar refractivity
78.38

Supplementary Information

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