3-Methyl-8-(3-methylbutylsulfanyl)-7-prop-2-enylpurine-2,6-dione structure

3-Methyl-8-(3-methylbutylsulfanyl)-7-prop-2-enylpurine-2,6-dione

3-methyl-8-(3-methylbutylsulfanyl)-7-prop-2-enylpurine-2,6-dione

Also Known As: Oprea1_404786|Oprea1_505281|BAS 00316207|3-methyl-8-(3-methylbutylsulfanyl)-7-prop-2-enylpurine-2,6-dione|AG-690/09162057|3-methyl-8-(3-methylbutylthio)-7-prop-2-enyl-1,3,7-trihydropurine-2,6-dione|F0372-0896|7-allyl-8-(isopentylthio)-3-methyl-1H-purine-2,6(3H,7H)-dione|7-Allyl-3-methyl-8-(3-methyl-butylsulfanyl)-3,7-dihydro-purine-2,6-dione|7-allyl-8-(isopentylthio)-3-methyl-3,7-dihydro-1H-purine-2,6-dione|3-methyl-8-[(3-methylbutyl)sulfanyl]-7-prop-2-enyl-3,7-dihydro-1H-purine-2,6-dione|3-methyl-8-[(3-methylbutyl)sulfanyl]-7-(prop-2-en-1-yl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione|6-hydroxy-3-methyl-8-[(3-methylbutyl)sulfanyl]-7-(prop-2-en-1-yl)-3,7-dihydro-2H-purin-2-one

CAS: 313552-32-8
Molecular Formula C14H20N4O2S
Molecular Weight 308.1307 g/mol
LogP 2.7
Topological Polar Surface Area 92.5 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 4
Rotatable Bonds 6
Exact Mass 308.1307
Monoisotopic Mass 308.1307
Heavy Atoms 21
Complexity 429.0

Chemical Identifiers

CAS Number 313552-32-8
SMILES CC(C)CCSC1=NC2=C(N1CC=C)C(=O)NC(=O)N2C
InChIKey WPPDGGCJCGKTDE-UHFFFAOYSA-N

Product Overview

3-Methyl-8-(3-methylbutylsulfanyl)-7-prop-2-enylpurine-2,6-dione (CAS 313552-32-8), with molecular formula C14H20N4O2S and molecular weight 308.1307 g/mol. IUPAC: 3-methyl-8-(3-methylbutylsulfanyl)-7-prop-2-enylpurine-2,6-dione.

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3-Methyl-8-(3-methylbutylsulfanyl)-7-prop-2-enylpurine-2,6-dione is a custom synthesis product. We offer services from milligram to kilogram scale.

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