Name: methyl 4-[3-(1-benzylimidazol-2-yl)prop-1-en-1-yl]-2-(4-fluorophenyl)benzoate
SMILES:
COC(=O)c1ccc(C=CCc2nccn2Cc2ccccc2)cc1-c1ccc(F)cc1Molecular Processing
Molecular formula
C27H23FN2O2
Molecular weight
426.49
Exact mass
426.1744
XLogP
5.78
TPSA
44.12
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
7
Heavy atoms
32
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
123.68
Supplementary Information
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