Name: Intermediate 34a
SMILES:
O=C(NNc1ccc(F)cn1)C1CCCCC1Molecular Processing
Molecular formula
C12H16FN3O
Molecular weight
237.28
Exact mass
237.1277
XLogP
2.24
TPSA
54.02
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
62.54
Supplementary Information
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