SMILES:
CCOC(=O)c1cc2cc(OCCOC)cc(NS(=O)(=O)c3ccccn3)c2[nH]1Molecular Processing
Molecular formula
C19H21N3O6S
Molecular weight
419.46
Exact mass
419.1151
XLogP
2.57
TPSA
119.61
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
9
Heavy atoms
29
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.263
Molar refractivity
106.67
Supplementary Information
Obteniendo detalles…
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