이름: 4-butyl-N-[4-(4-oxo-piperidine-1-yl)-phenyl]-benzenesulfonamide
SMILES:
CCCCc1ccc(S(=O)(=O)Nc2ccc(N3CCC(=O)CC3)cc2)cc1Molecular Processing
Molecular formula
C21H26N2O3S
Molecular weight
386.52
Exact mass
386.1664
XLogP
4
TPSA
66.48
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
27
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.381
Molar refractivity
108.76
Supplementary Information
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