이름: 2-morpholino-6-phenyl-5-p-tolylnicotinonitrile
SMILES:
Cc1ccc(-c2cc(C#N)c(N3CCOCC3)nc2-c2ccccc2)cc1Molecular Processing
Molecular formula
C23H21N3O
Molecular weight
355.44
Exact mass
355.1685
XLogP
4.43
TPSA
49.15
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
27
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.217
Molar refractivity
107.59
Supplementary Information
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