이름: 2-(1,3-Dioxo-1,3-dihydro-isoindol-2-yl)-ethanesulfonic acid (1-isopropyl-piperidin-4-yl)-methyl-amide
SMILES:
CC(C)N1CCC(N(C)S(=O)(=O)CCN2C(=O)c3ccccc3C2=O)CC1Molecular Processing
Molecular formula
C19H27N3O4S
Molecular weight
393.51
Exact mass
393.1722
XLogP
1.42
TPSA
78
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
27
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.579
Molar refractivity
103.09
Supplementary Information
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