SMILES:
CC(C)(C)c1ccc(S(=O)(=O)Nc2cc(Cl)cnc2-n2ncc3ncccc32)cc1Molecular Processing
Molecular formula
C21H20ClN5O2S
Molecular weight
441.94
Exact mass
441.1026
XLogP
4.57
TPSA
89.77
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
30
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
0.19
Molar refractivity
117.62
Supplementary Information
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