SMILES:
CSCn1c(-c2ccccc2)c(C)c(=O)[nH]c1=SMolecular Processing
Molecular formula
C13H14N2OS2
Molecular weight
278.4
Exact mass
278.0548
XLogP
3.2
TPSA
37.79
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.231
Molar refractivity
79.57
Supplementary Information
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