C=CCO[C@@H]1CCC[C@H](OCc2nc(-c3ccc(F)cc3)oc2C)C1
Name: 4-(cis-3-allyloxycyclohexyloxymethyl)-2-(4-fluorophenyl)-5-methyl-oxazole
SMILES: C=CCO[C@@H]1CCC[C@H](OCc2nc(-c3ccc(F)cc3)oc2C)C1

Molecular Processing

Molecular formula
C20H24FNO3
Molecular weight
345.41
Exact mass
345.174
XLogP
4.82
TPSA
44.49
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
25
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.45
Molar refractivity
93.62

Supplementary Information

Details werden geladen…

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