SMILES:
COc1ccc(-c2c3cccc(Cl)c3nn2C(C)C)c(C)c1Molecular Processing
Molecular formula
C18H19ClN2O
Molecular weight
314.82
Exact mass
314.1186
XLogP
5.25
TPSA
27.05
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
22
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.278
Molar refractivity
91.85
Supplementary Information
Details werden geladen…
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