Name: 1-benzyl-4-(benzothiophen-2-yl)piperazine
SMILES:
c1ccc(CN2CCN(c3cc4ccccc4s3)CC2)cc1Molecular Processing
Molecular formula
C19H20N2S
Molecular weight
308.45
Exact mass
308.1347
XLogP
4.22
TPSA
6.48
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
22
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.263
Molar refractivity
95.76
Supplementary Information
Details werden geladen…
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