SMILES:
C=CCC1C(=O)c2nc(C3CCCC3c3ccccc3)[nH]c2C(CC=C)C1=OMolecular Processing
Molecular formula
C24H26N2O2
Molecular weight
374.48
Exact mass
374.1994
XLogP
5.08
TPSA
62.82
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
28
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
4
Undefined stereo
4
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
109.56
Supplementary Information
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