COc1cc(-c2coc3c(/C=C/C=O)cnc(N)c23)ccc1NC(=O)c1nc2ccccc2n1C
SMILES: COc1cc(-c2coc3c(/C=C/C=O)cnc(N)c23)ccc1NC(=O)c1nc2ccccc2n1C

Molecular Processing

Molecular formula
C26H21N5O4
Molecular weight
467.49
Exact mass
467.1594
XLogP
4.44
TPSA
125.27
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
35
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.077
Molar refractivity
134.17

Supplementary Information

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