COC(=O)c1sc(C#CC(C)(C)C)cc1N(C(=O)C1CCC(C)CC1)N(C)C(=O)C(F)(F)F
SMILES: COC(=O)c1sc(C#CC(C)(C)C)cc1N(C(=O)C1CCC(C)CC1)N(C)C(=O)C(F)(F)F

Molecular Processing

Molecular formula
C23H29F3N2O4S
Molecular weight
486.56
Exact mass
486.18
XLogP
5.03
TPSA
66.92
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
33
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.609
Molar refractivity
119.42

Supplementary Information

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