SMILES:
O=C(CCSCC(=O)N1CCSCC1)OCc1ccccc1Molecular Processing
Molecular formula
C16H21NO3S2
Molecular weight
339.48
Exact mass
339.0963
XLogP
2.43
TPSA
46.61
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
22
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
92.09
Supplementary Information
Récupération des détails…
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