CN1C(=O)CCC2(C)c3ccc(C(=O)OC(c4ccccc4)c4ccccc4)cc3CCC12
SMILES: CN1C(=O)CCC2(C)c3ccc(C(=O)OC(c4ccccc4)c4ccccc4)cc3CCC12

Molecular Processing

Molecular formula
C29H29NO3
Molecular weight
439.56
Exact mass
439.2147
XLogP
5.46
TPSA
46.61
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
33
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.31
Molar refractivity
128.05

Supplementary Information

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