O=c1cc(-c2ccc(C(F)(F)F)nn2)cc[nH]1
名称: 4-(6-(trifluoromethyl)pyridazin-3-yl)pyridin-2(1H)-one
SMILES: O=c1cc(-c2ccc(C(F)(F)F)nn2)cc[nH]1

Molecular Processing

Molecular formula
C10H6F3N3O
Molecular weight
241.17
Exact mass
241.0463
XLogP
1.85
TPSA
58.64
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.1
Molar refractivity
53.09

Supplementary Information

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