CN1Cc2c(C=O)ncn2-c2cccc(Cl)c2C1=O
SMILES: CN1Cc2c(C=O)ncn2-c2cccc(Cl)c2C1=O

Molecular Processing

Molecular formula
C13H10ClN3O2
Molecular weight
275.69
Exact mass
275.0462
XLogP
1.92
TPSA
55.2
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
19
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.154
Molar refractivity
69.76

Supplementary Information

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