AC1LDZIX
3-[3-methyl-7-(3-methylbutyl)-2,6-dioxopurin-8-yl]sulfanylpropanoic acid
Also Known As: Oprea1_652794|BAS 00288330|3-((7-isopentyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)propanoic acid|AG-690/34686037|SR-01000363297-1|F0372-0756|3-[3-methyl-7-(3-methylbutyl)-2,6-dioxopurin-8-yl]sulfanylpropanoic acid|3-{[3-methyl-7-(3-methylbutyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}propanoic acid|3-[3-methyl-7-(3-methylbutyl)-2,6-dioxo-1,3,7-trihydropurin-8-ylthio]propanoic acid|3-[(7-isopentyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]propanoic acid
| Molecular Formula | C14H20N4O4S |
|---|---|
| Molecular Weight | 340.1205 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 340.1205 |
| Monoisotopic Mass | 340.1205 |
| Heavy Atoms | 23 |
| Complexity | 487.0 |
Chemical Identifiers
| CAS Number | 313530-86-8 |
|---|---|
| SMILES | CC(C)CCN1C2=C(N=C1SCCC(=O)O)N(C(=O)NC2=O)C |
| InChIKey | QXCWGGHMZUIVRZ-UHFFFAOYSA-N |
Product Overview
AC1LDZIX (CAS 313530-86-8), with molecular formula C14H20N4O4S and molecular weight 340.1205 g/mol. IUPAC: 3-[3-methyl-7-(3-methylbutyl)-2,6-dioxopurin-8-yl]sulfanylpropanoic acid.
AC1LDZIX is a custom synthesis product. We offer services from milligram to kilogram scale.
Request a Quote »