Name: 2-(2,3,3-Trimethyl-3H-indol-5-ylmethyl)-isoindole-1,3-dione
SMILES:
CC1=Nc2ccc(CN3C(=O)c4ccccc4C3=O)cc2C1(C)CMolecular Processing
Molecular formula
C20H18N2O2
Molecular weight
318.38
Exact mass
318.1368
XLogP
3.87
TPSA
49.74
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
24
Rings
4
Aromatic rings
2
Saturated rings
0
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
92.88
Supplementary Information
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