COC(=O)[C@H]1CN(/C(=N/C#N)Oc2ccccc2)CC[C@@H]1C(=O)N1CC[C@H](c2ccccc2)C1
SMILES: COC(=O)[C@H]1CN(/C(=N/C#N)Oc2ccccc2)CC[C@@H]1C(=O)N1CC[C@H](c2ccccc2)C1

Molecular Processing

Molecular formula
C26H28N4O4
Molecular weight
460.53
Exact mass
460.2111
XLogP
3.03
TPSA
95.23
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
34
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
3
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
125.68

Supplementary Information

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