CCOC(=O)CCCC(=O)c1cn(-c2cccnc2)c2ccccc12
SMILES: CCOC(=O)CCCC(=O)c1cn(-c2cccnc2)c2ccccc12

Molecular Processing

Molecular formula
C20H20N2O3
Molecular weight
336.39
Exact mass
336.1474
XLogP
3.94
TPSA
61.19
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
25
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
95.88

Supplementary Information

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