SMILES:
Cn1c(=O)c(CNC(CCO)c2ccccc2)nc2ccccc21Molecular Processing
Molecular formula
C19H21N3O2
Molecular weight
323.4
Exact mass
323.1634
XLogP
2.15
TPSA
67.15
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
24
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.263
Molar refractivity
94.71
Supplementary Information
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