COC(=O)/C=C/c1ccccc1NC(=O)C(c1ccc(CN2N=C(c3ccccc3)OCC2=O)cc1)C(C)C
SMILES: COC(=O)/C=C/c1ccccc1NC(=O)C(c1ccc(CN2N=C(c3ccccc3)OCC2=O)cc1)C(C)C

Molecular Processing

Molecular formula
C31H31N3O5
Molecular weight
525.61
Exact mass
525.2264
XLogP
4.97
TPSA
97.3
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
39
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.226
Molar refractivity
149.62

Supplementary Information

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