SMILES:
CN1CC(=O)N(Cc2ccc(-c3ccc4c(nnn4CC4CC4)c3Cl)cc2)C1=OMolecular Processing
Molecular formula
C21H20ClN5O2
Molecular weight
409.88
Exact mass
409.1306
XLogP
3.56
TPSA
71.33
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
29
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
109.27
Supplementary Information
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