SMILES:
CS(=O)(=O)N1CCN(Cc2cc3nc(Cl)nc(N4CCOCC4)c3s2)CC1Molecular Processing
Molecular formula
C16H22ClN5O3S2
Molecular weight
431.97
Exact mass
431.0853
XLogP
1.26
TPSA
78.87
H-bond donors
0
H-bond acceptors
8
Rotatable bonds
4
Heavy atoms
27
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.625
Molar refractivity
107.15
Supplementary Information
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