Name: methyl 6-[5-ethyl-2-(4-isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl)nicotinamido]hexanoate
SMILES:
CCc1cnc(C2=NC(C)(C(C)C)C(=O)N2)c(C(=O)NCCCCCC(=O)OC)c1Molecular Processing
Molecular formula
C22H32N4O4
Molecular weight
416.52
Exact mass
416.2424
XLogP
2.4
TPSA
109.75
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
30
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.591
Molar refractivity
114.35
Supplementary Information
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