SMILES:
CCN1CCCC1CNC(=O)c1cccc(C2Nc3ccc(C(=O)OC)cc3CC2(C)C)c1Molecular Processing
Molecular formula
C27H35N3O3
Molecular weight
449.6
Exact mass
449.2678
XLogP
4.42
TPSA
70.67
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
33
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.481
Molar refractivity
130.67
Supplementary Information
Récupération des détails…
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