Nombre: 3-pyridin-4-ylsulfanylpropan-1-amine
SMILES:
C1=CN=CC=C1SCCCNMolecular Processing
Molecular formula
C8H12N2S
Molecular weight
168.26
Exact mass
168.0721
XLogP
1.52
TPSA
38.91
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
48.63
Supplementary Information
InChIKey: PXIKCDINXIEYST-UHFFFAOYSA-N
Sinónimos
4-(3-aminopropylthio)pyridineSCHEMBL6215228PXIKCDINXIEYST-UHFFFAOYSA-NAKOS017530133
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