COC(=O)c1cc2ccc(SCCCc3cc4c(cc3OCc3ccccc3)CC(CCc3ccccc3)O4)cc2nc1OC
الاسم: 6-[3-(carbomethoxy-2-methoxyquinolin-7-yl)thiopropyl]-5-benzyloxy-2-(2-phenylethyl)-2,3-dihydrobenzofuran
SMILES: COC(=O)c1cc2ccc(SCCCc3cc4c(cc3OCc3ccccc3)CC(CCc3ccccc3)O4)cc2nc1OC

Molecular Processing

Molecular formula
C38H37NO5S
Molecular weight
619.78
Exact mass
619.2392
XLogP
8.27
TPSA
66.88
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
13
Heavy atoms
45
Rings
6
Aromatic rings
5
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.263
Molar refractivity
178.78

Supplementary Information

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