SMILES:
COc1cc(OCc2ccccn2)c(/C=C/C(=O)c2ccc(S(N)(=O)=O)cc2)cc1-c1cccs1Molecular Processing
Molecular formula
C26H22N2O5S2
Molecular weight
506.61
Exact mass
506.097
XLogP
4.94
TPSA
108.58
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
9
Heavy atoms
35
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.077
Molar refractivity
136.06
Supplementary Information
Details werden geladen…
An 1 Reaktionen beteiligt→