CC(C)(C)OC(=O)N1CCC(Nc2nc(N)c(C(=O)c3cccc(F)c3)s2)CC1
SMILES: CC(C)(C)OC(=O)N1CCC(Nc2nc(N)c(C(=O)c3cccc(F)c3)s2)CC1

Molecular Processing

Molecular formula
C20H25FN4O3S
Molecular weight
420.51
Exact mass
420.1631
XLogP
3.91
TPSA
97.55
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
29
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.45
Molar refractivity
110.81

Supplementary Information

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