CC1=NC=C(C=C1)C2=NC(=CN2C3=CC=C(C=C3)S(=O)(=O)C)C(F)(F)F
Nom: 2-methyl-5-[1-(4-methylsulfonylphenyl)-4-(trifluoromethyl)imidazol-2-yl]pyridine
SMILES: CC1=NC=C(C=C1)C2=NC(=CN2C3=CC=C(C=C3)S(=O)(=O)C)C(F)(F)F

Molecular Processing

Molecular formula
C17H14F3N3O2S
Molecular weight
381.38
Exact mass
381.0759
XLogP
3.67
TPSA
64.85
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
26
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.176
Molar refractivity
89.64

Supplementary Information

InChIKey: TZUKXDRCVJCLLL-UHFFFAOYSA-N
Synonymes
CHEMBL3257905-[1-(4-Methanesulfonyl-phenyl)-4-trifluoromethyl-1H-imidazol-2-yl]-2-methyl-pyridineSCHEMBL214170BDBM500912082-methyl-5-[1-[4-(methylsulfonyl)phenyl]-4-trifluoromethyl-1h-imidazol-2-yl]pyridine
Voir la source →
Impliqué dans 6 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→