CC1(C)C(=O)Nc2ccc(-c3ccc(F)c(Cl)c3)cc21
SMILES: CC1(C)C(=O)Nc2ccc(-c3ccc(F)c(Cl)c3)cc21

Molecular Processing

Molecular formula
C16H13ClFNO
Molecular weight
289.74
Exact mass
289.067
XLogP
4.38
TPSA
29.1
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
20
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.188
Molar refractivity
78.5

Supplementary Information

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