Nombre: 1-[4-(4-pyridin-4-ylpiperazin-1-yl)phenyl]ethanone
SMILES:
CC(=O)c1ccc(N2CCN(c3ccncc3)CC2)cc1Molecular Processing
Molecular formula
C17H19N3O
Molecular weight
281.36
Exact mass
281.1528
XLogP
2.61
TPSA
36.44
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
21
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.294
Molar refractivity
85.11
Supplementary Information
InChIKey: WFKZTRIUEJJKPI-UHFFFAOYSA-N
Sinónimos
SCHEMBL7956272WFKZTRIUEJJKPI-UHFFFAOYSA-N1-(4-acetylphenyl)-4-(4-pyridyl)piperazine
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