Name: 5-[2-(8-methoxy-2,3,6,7-tetrahydro-1H,5H-benzo[ij]quinolizine-9-yl)vinyl]thiophene-2-carboaldehyde
SMILES:
COc1c(C=Cc2ccc(C=O)s2)cc2c3c1CCCN3CCC2Molecular Processing
Molecular formula
C20H21NO2S
Molecular weight
339.46
Exact mass
339.1293
XLogP
4.44
TPSA
29.54
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
24
Rings
4
Aromatic rings
2
Saturated rings
0
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.35
Molar refractivity
100.48
Supplementary Information
Details werden geladen…
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