CC(C)(C)OC(=O)COc1cccc(C(=O)C=Cc2cccnc2)c1
SMILES: CC(C)(C)OC(=O)COc1cccc(C(=O)C=Cc2cccnc2)c1

Molecular Processing

Molecular formula
C20H21NO4
Molecular weight
339.39
Exact mass
339.1471
XLogP
3.7
TPSA
65.49
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
25
Rings
2
Aromatic rings
2
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
95.38

Supplementary Information

Details werden geladen…

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