SMILES:
CN1Cc2ccc(N3CCN(C(=O)OC(C)(C)C)CC3)cc2C1=OMolecular Processing
Molecular formula
C18H25N3O3
Molecular weight
331.42
Exact mass
331.1896
XLogP
2.33
TPSA
53.09
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
24
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
92.26
Supplementary Information
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