이름: 1-benzo[b]thiophen-4-yl-4-(3-chloropropyl)piperazine
SMILES:
ClCCCN1CCN(c2cccc3sccc23)CC1Molecular Processing
Molecular formula
C15H19ClN2S
Molecular weight
294.85
Exact mass
294.0957
XLogP
3.65
TPSA
6.48
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
19
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
0.467
Molar refractivity
85.82
Supplementary Information
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