SMILES:
COc1ccc(-c2nnc(Cl)c3cc(OC)ccc23)cc1Molecular Processing
Molecular formula
C16H13ClN2O2
Molecular weight
300.75
Exact mass
300.0666
XLogP
3.97
TPSA
44.24
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
21
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
83.09
Supplementary Information
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