SMILES:
O=S1(=O)N(CCCCN2CCOCC2)c2ccccc2N1c1ccc(Cl)cc1Molecular Processing
Molecular formula
C20H24ClN3O3S
Molecular weight
421.95
Exact mass
421.1227
XLogP
3.66
TPSA
53.09
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
28
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
112.79
Supplementary Information
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