Name: N-(5-bromo-4′-methoxy-3H-spiro[benzofuran-2,1′-cyclohexane]-3-ylidene)-2-methylpropane-2-sulfinamide
SMILES:
COC1CCC2(CC1)Oc1ccc(Br)cc1C2=NS(=O)C(C)(C)CMolecular Processing
Molecular formula
C18H24BrNO3S
Molecular weight
414.37
Exact mass
413.066
XLogP
4.42
TPSA
47.89
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
24
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.611
Molar refractivity
101.2
Supplementary Information
Details werden geladen…
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