SMILES:
CN1CCN(S(=O)(=O)c2ccc(C(CC3CCCC3)C(=O)O)cc2)CC1Molecular Processing
Molecular formula
C19H28N2O4S
Molecular weight
380.51
Exact mass
380.177
XLogP
2.37
TPSA
77.92
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
26
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.632
Molar refractivity
99.65
Supplementary Information
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Involved in 5 reactions→