Name: 1-[(2'-carbomethoxybiphenyl-4-yl)methyl]-2-butyl-4-chloro-5-hydroxymethylimidazole
SMILES:
CCCCc1nc(Cl)c(CO)n1Cc1ccc(-c2ccccc2C(=O)OC)cc1Molecular Processing
Molecular formula
C23H25ClN2O3
Molecular weight
412.92
Exact mass
412.1554
XLogP
4.87
TPSA
64.35
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
29
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.304
Molar refractivity
114.09
Supplementary Information
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