SMILES:
CCOc1ccc2c(C#N)c(-c3ccc(NC(=O)C4CC4)cc3)n(CC)c2c1Molecular Processing
Molecular formula
C23H23N3O2
Molecular weight
373.46
Exact mass
373.179
XLogP
4.95
TPSA
67.05
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
28
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.304
Molar refractivity
110.29
Supplementary Information
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