SMILES:
CCOC(=O)N1CCC(=Nc2c(Cl)cccc2Cl)CC1Molecular Processing
Molecular formula
C14H16Cl2N2O2
Molecular weight
315.2
Exact mass
314.0589
XLogP
4.32
TPSA
41.9
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
81.39
Supplementary Information
Récupération des détails…
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