SMILES:
O=C(CN1CCC(N2Cc3ccccc3NC2=O)CC1)c1ccc2c(c1)OCO2Molecular Processing
Molecular formula
C22H23N3O4
Molecular weight
393.44
Exact mass
393.1689
XLogP
3.11
TPSA
71.11
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
29
Rings
5
Aromatic rings
2
Saturated rings
1
Aliphatic rings
3
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
107.36
Supplementary Information
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