SMILES:
CS(=O)(=O)C(=C1CN(C(c2ccc(Cl)cc2)c2ccc(CN3CCCCC3)cc2)C1)c1cc(F)cc(F)c1Molecular Processing
Molecular formula
C30H31ClF2N2O2S
Molecular weight
557.11
Exact mass
556.1763
XLogP
6.47
TPSA
40.62
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
38
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
148.56
Supplementary Information
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