SMILES:
Cc1c(S(=O)(=O)Nc2ccc3[nH]cc(CCN(C)C)c3c2)sc2ccc(Cl)cc12Molecular Processing
Molecular formula
C21H22ClN3O2S2
Molecular weight
448.01
Exact mass
447.0842
XLogP
5.25
TPSA
65.2
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
29
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.238
Molar refractivity
122.94
Supplementary Information
Details werden geladen…
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