SMILES:
CCOC(CN1CCN(S(=O)(=O)c2ccc3nc[nH]c(=O)c3c2)CC1)c1ccccc1Molecular Processing
Molecular formula
C22H26N4O4S
Molecular weight
442.54
Exact mass
442.1675
XLogP
2.01
TPSA
95.6
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
31
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
118.37
Supplementary Information
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