SMILES:
CCCC(NC(=O)Oc1ccccc1)C(=O)NC(C)COc1ccc(C#N)cc1Molecular Processing
Molecular formula
C22H25N3O4
Molecular weight
395.46
Exact mass
395.1845
XLogP
3.4
TPSA
100.45
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
9
Heavy atoms
29
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.318
Molar refractivity
108.55
Supplementary Information
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