Name: N,N′-bis(3-acetylphenyl)pentanediamide
SMILES:
CC(=O)c1cccc(NC(=O)CCCC(=O)Nc2cccc(C(C)=O)c2)c1Molecular Processing
Molecular formula
C21H22N2O4
Molecular weight
366.42
Exact mass
366.158
XLogP
3.84
TPSA
92.34
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
27
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.238
Molar refractivity
104
Supplementary Information
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