CC(C)(C)OC(=O)N1CCC(C)(c2nc(-c3cccc(NS(=O)(=O)c4c(F)cccc4F)c3F)c(-c3ccnc(N)n3)s2)CC1
SMILES: CC(C)(C)OC(=O)N1CCC(C)(c2nc(-c3cccc(NS(=O)(=O)c4c(F)cccc4F)c3F)c(-c3ccnc(N)n3)s2)CC1

Molecular Processing

Molecular formula
C30H31F3N6O4S2
Molecular weight
660.74
Exact mass
660.18
XLogP
6.36
TPSA
140.4
H-bond donors
2
H-bond acceptors
9
Rotatable bonds
6
Heavy atoms
45
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
15
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
164.51

Supplementary Information

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