SMILES:
CNC(=O)OC1CN(C)C(=O)N1c1cc(OC)c(Cl)cc1FMolecular Processing
Molecular formula
C13H15ClFN3O4
Molecular weight
331.73
Exact mass
331.0735
XLogP
2.04
TPSA
71.11
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
22
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
77.8
Supplementary Information
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