Name: (5-amino-1,3-dioxo-1,3-dihydro-isoindol-2-yl)-acetic acid ethyl ester
SMILES:
CCOC(=O)CN1C(=O)c2ccc(N)cc2C1=OMolecular Processing
Molecular formula
C12H12N2O4
Molecular weight
248.24
Exact mass
248.0797
XLogP
0.43
TPSA
89.7
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
62.85
Supplementary Information
Details werden geladen…
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