SMILES:
COC(=O)c1ccc(C=CC2CC(NS(=O)(=O)c3ccc(Cl)cc3)CN2)cc1Molecular Processing
Molecular formula
C20H21ClN2O4S
Molecular weight
420.92
Exact mass
420.0911
XLogP
2.85
TPSA
84.5
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
28
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
108.78
Supplementary Information
Obteniendo detalles…
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