Nombre: 1-hydroxy-3-(thiiran-2-ylmethoxy)-9H-thioxanthen-9-one
SMILES:
O=c1c2ccccc2sc2cc(OCC3CS3)cc(O)c12Molecular Processing
Molecular formula
C16H12O3S2
Molecular weight
316.4
Exact mass
316.0228
XLogP
3.61
TPSA
46.53
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
21
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.188
Molar refractivity
89.01
Supplementary Information
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