CCCCn1ccc2c(N(C)S(C)(=O)=O)cc(C(=O)NC(Cc3cc(F)cc(F)c3)C(O)CNCc3cccc(CC)c3)cc21
SMILES: CCCCn1ccc2c(N(C)S(C)(=O)=O)cc(C(=O)NC(Cc3cc(F)cc(F)c3)C(O)CNCc3cccc(CC)c3)cc21

Molecular Processing

Molecular formula
C34H42F2N4O4S
Molecular weight
640.8
Exact mass
640.2895
XLogP
5.17
TPSA
103.67
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
15
Heavy atoms
45
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.382
Molar refractivity
174.94

Supplementary Information

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