الاسم: trans-2-phenylcyclopentanecarboxylic acid (3,5-diallyl-2-amino-4,6-dioxo-cyclohex-1-enyl)amide
SMILES:
C=CCC1C(=O)C(NC(=O)[C@@H]2CCC[C@H]2c2ccccc2)=C(N)C(CC=C)C1=OMolecular Processing
Molecular formula
C24H28N2O3
Molecular weight
392.5
Exact mass
392.21
XLogP
3.39
TPSA
89.26
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
29
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
4
Undefined stereo
2
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
112.5
Supplementary Information
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