Nombre: product
SMILES:
Cc1ccc(S(=O)(=O)OCC2CN(Cc3ccccc3)CC2c2cc(Br)cs2)cc1Molecular Processing
Molecular formula
C23H24BrNO3S2
Molecular weight
506.49
Exact mass
505.0381
XLogP
5.44
TPSA
46.61
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
30
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.304
Molar refractivity
124.29
Supplementary Information
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