Name: product
SMILES:
CC(C)(O)C(=O)c1oc2nc(-c3ccccc3Cl)c(-c3ccc(Cl)cc3)cc2c1NMolecular Processing
Molecular formula
C23H18Cl2N2O3
Molecular weight
441.31
Exact mass
440.0694
XLogP
6
TPSA
89.35
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
30
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.13
Molar refractivity
119.94
Supplementary Information
Details werden geladen…
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