Name: 3-chloro-5-(4-phenoxyphenyl)isonicotinonitrile
SMILES:
N#Cc1c(Cl)cncc1-c1ccc(Oc2ccccc2)cc1Molecular Processing
Molecular formula
C18H11ClN2O
Molecular weight
306.75
Exact mass
306.056
XLogP
5.07
TPSA
45.91
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
22
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0
Molar refractivity
85.91
Supplementary Information
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