Nom: N-(3-pyridin-4-ylsulfanylpropyl)dodecan-1-amine
SMILES:
CCCCCCCCCCCCNCCCSC1=CC=NC=C1Molecular Processing
Molecular formula
C20H36N2S
Molecular weight
336.59
Exact mass
336.2599
XLogP
6.07
TPSA
24.92
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
16
Heavy atoms
23
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
0.75
Molar refractivity
104.29
Supplementary Information
InChIKey: LSNVXZINYPJURA-UHFFFAOYSA-N
Synonymes
SCHEMBL8967318LSNVXZINYPJURA-UHFFFAOYSA-N4-[3-(N-dodecylamino)propylthio]pyridine
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