Nom: 4-(Furan-3-ylmethylsulfanylmethyl)-6-(2-methoxyphenyl)-2,2-dimethyl-1,2-dihydroquinoline
SMILES:
COc1ccccc1-c1ccc2c(c1)C(CSCc1ccoc1)=CC(C)(C)N2Molecular Processing
Molecular formula
C24H25NO2S
Molecular weight
391.54
Exact mass
391.1606
XLogP
6.48
TPSA
34.4
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
28
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
118.98
Supplementary Information
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