Unii-8aap8G8ode
(2S)-2-[(S)-(2-(123I)iodophenoxy)-phenylmethyl]morpholine
Molecular Identity
Unii-8aap8G8ode
(2S)-2-[(S)-(2-(123I)iodophenoxy)-phenylmethyl]morpholine
PubChem CID: 16037656
2D Structure
Properties
C17H18INO2
Molecular Formula
391.23
Molecular Weight
g/mol
391.0393
Exact Mass
Da
3.3
XLogP
Drug-like (Lipinski: < 5)
30.5
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
3
H-Bond Acceptors
309
Complexity
SMILES
Canonical SMILES
SMILES: C1COC(CN1)C(C2=CC=CC=C2)OC3=CC=CC=C3IIsomeric SMILES
SMILES: C1CO[C@@H](CN1)[C@H](C2=CC=CC=C2)OC3=CC=CC=C3[123I]Synonyms(12)
UNII-8AAP8G8ODE8AAP8G8ODEIner I-123918657-07-5(123I)INER123-I INER(123)I-INERMorpholine, 2-((S)-(2-(iodo-123I)phenoxy)phenylmethyl)-, (2S)-SCHEMBL29935894(123I)-INER(2S)-2-[(S)-(2-(123I)iodanylphenoxy)-phenylmethyl]morpholine2(S)-((S)-(2-(123I)IODOPHENOXY) (PHENYL)METHYL)MORPHOLINE
Data from PubChem (NCBI)
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