SMILES:
Clc1ccc(CNCCOc2cccc(-c3noc4ccsc34)c2)cc1ClMolecular Processing
Molecular formula
C20H16Cl2N2O2S
Molecular weight
419.33
Exact mass
418.031
XLogP
6.03
TPSA
47.29
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
27
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.15
Molar refractivity
110.99
Supplementary Information
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