Name: 1-(phenylmethyl)piperazinone
SMILES:
Cl.O=C1CNCCN1Cc1ccccc1Molecular Processing
Molecular formula
C11H15ClN2O
Molecular weight
226.71
Exact mass
226.0873
XLogP
1.04
TPSA
32.34
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
2
Fraction Csp3
0.364
Molar refractivity
61.98
Supplementary Information
Details werden geladen…
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