이름: 2-phenylthiomethyl-4-phenylsaccharin
SMILES:
O=C1c2c(-c3ccccc3)cccc2S(=O)(=O)N1CSc1ccccc1Molecular Processing
Molecular formula
C20H15NO3S2
Molecular weight
381.48
Exact mass
381.0493
XLogP
4.25
TPSA
54.45
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
26
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.05
Molar refractivity
102.4
Supplementary Information
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