SMILES:
O=C1c2c(I)cccc2CN1Cc1ccc(Cl)cc1Molecular Processing
Molecular formula
C15H11ClINO
Molecular weight
383.62
Exact mass
382.9574
XLogP
4.1
TPSA
20.31
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
19
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
0.133
Molar refractivity
84.19
Supplementary Information
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