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8-[(6-Iodobenzo[d][1,3]dioxol-5-yl)thio]-9H-purin-6-amine

8-[(6-Iodobenzo[d][1,3]dioxol-5-yl)thio]-9H-purin-6-amine - CAS 873436-89-6

Catalog:	BB038389
Product Name:	8-[(6-Iodobenzo[d][1,3]dioxol-5-yl)thio]-9H-purin-6-amine
CAS:	873436-89-6
Synonyms:	8-[(6-iodo-1,3-benzodioxol-5-yl)thio]-7H-purin-6-amine; 8-[(6-iodo-1,3-benzodioxol-5-yl)sulfanyl]-7H-purin-6-amine

8-[(6-Iodobenzo[d][1,3]dioxol-5-yl)thio]-9H-purin-6-amine

Technical Data

Patents

Computed Properties

IUPAC Name:	8-[(6-iodo-1,3-benzodioxol-5-yl)sulfanyl]-7H-purin-6-amine
Description:	8-[(6-Iodobenzo[d][1,3]dioxol-5-yl)thio]-9H-purin-6-amine (CAS# 873436-89-6) is used in the development of mitochondrial TRAP1 inhibitor that suppresses cell death and reprograms energy metabolism in cancer cells.
Molecular Weight:	413.19
Molecular Formula:	C12H8IN5O2S
Canonical SMILES:	C1OC2=CC(=C(C=C2O1)I)SC3=NC4=C(N3)C(=NC=N4)N
InChI:	InChI=1S/C12H8IN5O2S/c13-5-1-6-7(20-4-19-6)2-8(5)21-12-17-9-10(14)15-3-16-11(9)18-12/h1-3H,4H2,(H3,14,15,16,17,18)
InChI Key:	BFOWGJNWQLLISB-UHFFFAOYSA-N
LogP:	3.00080

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