8-(Hexylthio)-3,9-dihydro-1,3-dimethyl-1H-purine-2,6-dithione
8-hexylsulfanyl-1,3-dimethyl-7H-purine-2,6-dithione
Also Known As: Theophylline, 8-(hexylthio)dithio-|Theophylline, 2,6-dithio-8-hexylthio-|2,6-Dithio-8-n-hexylthiotheophylline|2,6-Dithio-8-(N-hexylthio)theophylline|Theophylline,8-(hexylthio)dithio|Theophylline, 2,6-dithio-(8-hexylthio)-|2,6-Dithio-8-hexylthiotheophylline|8-(Hexylthio)-2,6-dithiotheophylline|Theophylline,6-dithio-(8-hexylthio)-|Uric acid, 1,3-dimethyl-2,6-dithio-8-hexylthio-|Theophylline, 8-(hexylthio)dithio-(8CI)|1,3-Dimethyl-8- -1H-purine-2,6 -dithione|8-hexylsulfanyl-1,3-dimethyl-7H-purine-2,6-dithione|Uric acid,3-dimethyl-2,6-dithio-(8-hexylthio)-|8-(Hexylthio)-3,9-dihydro-1,3-dimethyl-1H-purine-2,6-dithione|1,3-Dimethyl-8-(hexylthio)-1H-purine-2,6(3H,7H)-dithione|1H-PURINE-2,6-DITHIONE, 8-(HEXYLTHIO)-3,9-DIHYDRO-1,3-DIMETHYL-|8-(hexylthio)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dithione|8-(Hexylsulfanyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dithione|8-(hexylsulfanyl)-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dithione
| Molecular Formula | C13H20N4S3 |
|---|---|
| Molecular Weight | 328.08502 g/mol |
| LogP | 4.37128 |
| Topological Polar Surface Area | 38.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 328.08502 |
| Monoisotopic Mass | 328.08502 |
| Heavy Atoms | 20 |
| Complexity | 710.7002 |
Chemical Identifiers
| CAS Number | 6466-22-4 |
|---|---|
| SMILES | CCCCCCSC1=NC2=C(N1)C(=S)N(C(=S)N2C)C |
Product Overview
8-(Hexylthio)-3,9-dihydro-1,3-dimethyl-1H-purine-2,6-dithione (CAS 6466-22-4), with molecular formula C13H20N4S3 and molecular weight 328.08502 g/mol. IUPAC: 8-hexylsulfanyl-1,3-dimethyl-7H-purine-2,6-dithione.
8-(Hexylthio)-3,9-dihydro-1,3-dimethyl-1H-purine-2,6-dithione is a custom synthesis product. We offer services from milligram to kilogram scale.
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