SMILES:
CC(C)n1nc(C[C@@H]2CCN(C(=O)C3CC3)C2)n(-c2ccc(-c3ccc4occc4c3)cc2)c1=OMolecular Processing
Molecular formula
C28H30N4O3
Molecular weight
470.57
Exact mass
470.2318
XLogP
4.83
TPSA
73.27
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
35
Rings
6
Aromatic rings
4
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.393
Molar refractivity
134.53
Supplementary Information
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