Thiazolidine, 3-(6-(5-iodo-2-pyridyloxy)hexyl)-, hydrochloride

HCID 218545

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Basic information

CAS: 40771-34-4
Standard SMILES: Cl.Ic1ccc(OCCCCCCN2CCSC2)nc1
InChIKey: IKLQOPICWGDGGF-UHFFFAOYSA-N
Molecular formula: C14H22ClIN2OS
Average molar mass: 428.8 g/mol
Monoisotopic mass: 428.01861

Names & identifiers

Preferred name: Thiazolidine, 3-(6-(5-iodo-2-pyridyloxy)hexyl)-, hydrochloride
IUPAC: 3-[6-[(5-iodo-2-pyridinyl)oxy]hexyl]-1,3-thiazolidine;hydrochloride

Names & synonyms

40771-34-4Thiazolidine, 3-(6-(5-iodo-2-pyridyloxy)hexyl)-, hydrochloride3-(6-(5-Iodo-2-pyridyloxy)hexyl)thiazolidine hydrochlorideDTXSID80193762Pyridine, 5-iodo-2-(6-(3-thiazolidinyl)hexyloxy)-, hydrochlorideRefChem:384743DTXCID201162535-Iodo-2-{[6-(1,3-thiazolidin-3-yl)hexyl]oxy}pyridine--hydrogen chloride (1/1)

Database identifiers

CAS: 40771-34-4
PubChem CID: 218545
DTXSID: DTXSID80193762

Properties

Computed structural properties

Topological polar surface area: 50.7 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 8
Heavy atoms: 20
Formal charge: 0
Complexity: 245

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