7-(2-chlorobenzyl)-8-(isopentylthio)-3-methyl-3,7-dihydro-1H-purine-2,6-dione

Modify Date: 2025-10-18 10:44:54

7-(2-chlorobenzyl)-8-(isopentylthio)-3-methyl-3,7-dihydro-1H-purine-2,6-dione Structure
7-(2-chlorobenzyl)-8-(isopentylthio)-3-methyl-3,7-dihydro-1H-purine-2,6-dione structure
Common Name 7-(2-chlorobenzyl)-8-(isopentylthio)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
CAS Number 313470-33-6 Molecular Weight 392.903
Density 1.4±0.1 g/cm3 Boiling Point N/A
Molecular Formula C18H21ClN4O2S Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 7-(2-Chlorobenzyl)-3-methyl-8-[(3-methylbutyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.4±0.1 g/cm3
Molecular Formula C18H21ClN4O2S
Molecular Weight 392.903
Exact Mass 392.107361
LogP 4.94
Index of Refraction 1.666
InChIKey FONITDQXPDSLEG-UHFFFAOYSA-N
SMILES CC(C)CCSc1nc2c(c(=O)[nH]c(=O)n2C)n1Cc1ccccc1Cl

 Synonyms

7-(2-Chlorobenzyl)-3-methyl-8-[(3-methylbutyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
1H-Purine-2,6-dione, 7-[(2-chlorophenyl)methyl]-3,7-dihydro-3-methyl-8-[(3-methylbutyl)thio]-
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