O=C(NCCc1ccc(-n2cc(-c3ccccc3)nc2C(F)(F)F)cc1)Oc1ccccc1
Name: phenyl 2-{4-[4-phenyl-2-(trifluoromethyl)-1H-imidazol-1-yl]phenyl}ethylcarbamate
SMILES: O=C(NCCc1ccc(-n2cc(-c3ccccc3)nc2C(F)(F)F)cc1)Oc1ccccc1

Molecular Processing

Molecular formula
C25H20F3N3O2
Molecular weight
451.45
Exact mass
451.1508
XLogP
5.89
TPSA
56.15
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
33
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.12
Molar refractivity
118.17

Supplementary Information

Details werden geladen…

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