SMILES:
COc1cc2c3c(cccc3c1N1CCN(C)CC1)C(=O)N(OCc1ccccc1)C2=OMolecular Processing
Molecular formula
C25H25N3O4
Molecular weight
431.49
Exact mass
431.1845
XLogP
3.33
TPSA
62.32
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
32
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.28
Molar refractivity
121.94
Supplementary Information
Récupération des détails…
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