Name: 2-(((2S,4R)-1-(biphenylcarbonyl)-4-hydroxypyrrolidin-2-yl)methyl)isoindoline-1,3-dione
SMILES:
O=C1c2ccccc2C(=O)N1C[C@@H]1C[C@@H](O)CN1C(=O)c1ccccc1-c1ccccc1Molecular Processing
Molecular formula
C26H22N2O4
Molecular weight
426.47
Exact mass
426.158
XLogP
3.23
TPSA
77.92
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
32
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.192
Molar refractivity
119.14
Supplementary Information
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