O=C1Nc2cc(Cl)cc3c2N(CC3)c2ccccc21
SMILES: O=C1Nc2cc(Cl)cc3c2N(CC3)c2ccccc21

Molecular Processing

Molecular formula
C15H11ClN2O
Molecular weight
270.72
Exact mass
270.056
XLogP
3.6
TPSA
32.34
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
19
Rings
4
Aromatic rings
2
Saturated rings
0
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.133
Molar refractivity
76.56

Supplementary Information

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