SMILES:
CCCC(=NOCC)C1=C(O)CC(c2c(C)cc(C)c(N)c2C)CC1=OMolecular Processing
Molecular formula
C21H30N2O3
Molecular weight
358.48
Exact mass
358.2256
XLogP
4.65
TPSA
84.91
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
26
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.524
Molar refractivity
105.67
Supplementary Information
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