CC(C)(C)OC(=O)NC1=NC2(c3cc(NC4CCCC4)ccc3F)OCCC2CS1
SMILES: CC(C)(C)OC(=O)NC1=NC2(c3cc(NC4CCCC4)ccc3F)OCCC2CS1

Molecular Processing

Molecular formula
C22H30FN3O3S
Molecular weight
435.57
Exact mass
435.1992
XLogP
5
TPSA
71.95
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
30
Rings
4
Aromatic rings
1
Saturated rings
2
Aliphatic rings
3
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.636
Molar refractivity
117.28

Supplementary Information

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