SMILES:
O=C1NC(=O)C(=Cc2ccc(N3CCC4(CC3)OCCO4)c(F)c2)S1Molecular Processing
Molecular formula
C17H17FN2O4S
Molecular weight
364.4
Exact mass
364.0893
XLogP
2.49
TPSA
67.87
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
2
Heavy atoms
25
Rings
4
Aromatic rings
1
Saturated rings
3
Aliphatic rings
3
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.412
Molar refractivity
91.59
Supplementary Information
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