AC1LJVSG

2-[3-methyl-7-(3-methylbutyl)-2,6-dioxopurin-8-yl]sulfanyl-N-phenylacetamide

Also Known As: Oprea1_230234|Oprea1_629575|BAS 00288332|NCGC00280768-01|AB00124372-02|AB00124372-03|2-((7-isopentyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)-N-phenylacetamide|AG-690/09078055|SR-01000398341-1|2-{[3-methyl-7-(3-methylbutyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}-N-phenylacetamide|F0017-1653|2-[3-methyl-7-(3-methylbutyl)-2,6-dioxopurin-8-yl]sulfanyl-N-phenylacetamide|2-[(7-isopentyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]-N-phenylacetamide|2-[(7-isopentyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio]-N-phenylacetamide|2-[3-methyl-7-(3-methylbutyl)-2,6-dioxo(1,3,7-trihydropurin-8-ylthio)]-N-pheny lacetamide|2-{[6-hydroxy-3-methyl-7-(3-methylbutyl)-2-oxo-3,7-dihydro-2H-purin-8-yl]sulfanyl}-N-phenylacetamide

Molecular Formula	C19H23N5O3S
Molecular Weight	401.15216 g/mol
LogP	2.2002
Topological Polar Surface Area	101.78 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	7
Exact Mass	401.15216
Monoisotopic Mass	401.15216
Heavy Atoms	28
Complexity	1098.44

Chemical Identifiers

CAS Number	313530-87-9
SMILES	CC(C)CCN1C2=C(N=C1SCC(=O)NC3=CC=CC=C3)N(C(=O)NC2=O)C