이름: product
SMILES:
CC(C)(C)OC(=O)CNc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1NMolecular Processing
Molecular formula
C18H22FN3O4S
Molecular weight
395.46
Exact mass
395.1315
XLogP
2.96
TPSA
110.52
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
27
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.278
Molar refractivity
102.4
Supplementary Information
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