SMILES:
O=C(CC1c2ccccc2-c2ccccc2N1S(=O)(=O)c1ccc(Cl)c(Cl)c1)NC1CCC(CCN2CCCC2)CC1Molecular Processing
Molecular formula
C33H37Cl2N3O3S
Molecular weight
626.65
Exact mass
625.1933
XLogP
7.46
TPSA
69.72
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
42
Rings
6
Aromatic rings
3
Saturated rings
2
Aliphatic rings
3
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.424
Molar refractivity
169.54
Supplementary Information
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