SMILES:
O=C1C=C(Nc2ccc(Cl)cc2)OC1=Cc1c[nH]c2ncccc12Molecular Processing
Molecular formula
C18H12ClN3O2
Molecular weight
337.77
Exact mass
337.0618
XLogP
4.11
TPSA
67.01
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
24
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0
Molar refractivity
93.32
Supplementary Information
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