SMILES:
NC(=O)C1C2C=CC(C2)C1Nc1nc(Cl)ncc1ClMolecular Processing
Molecular formula
C12H12Cl2N4O
Molecular weight
299.16
Exact mass
298.0388
XLogP
1.87
TPSA
80.9
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
19
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
4
Undefined stereo
4
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
72.88
Supplementary Information
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Involved in 35 reactions→