الاسم: 5-(benzylthio)-1,3,4-thiadiazole-2-thiol
SMILES:
Sc1nnc(SCc2ccccc2)s1Molecular Processing
Molecular formula
C9H8N2S3
Molecular weight
240.38
Exact mass
239.985
XLogP
3.12
TPSA
25.78
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
14
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
0.111
Molar refractivity
63.16
Supplementary Information
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