8-(sec-butylthio)-3-methyl-7-(3-phenylpropyl)-1H-purine-2,6(3H,7H)-dione
8-butan-2-ylsulfanyl-3-methyl-7-(3-phenylpropyl)purine-2,6-dione
Also Known As: Oprea1_177464|Oprea1_254863|BAS 00553111|8-(sec-butylthio)-3-methyl-7-(3-phenylpropyl)-1H-purine-2,6(3H,7H)-dione|AG-690/11451143|F0372-0196|8-butan-2-ylsulfanyl-3-methyl-7-(3-phenylpropyl)purine-2,6-dione|8-(butan-2-ylsulfanyl)-3-methyl-7-(3-phenylpropyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione|3-methyl-8-(methylpropylthio)-7-(3-phenylpropyl)-1,3,7-trihydropurine-2,6-dion e|8-(butan-2-ylsulfanyl)-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione|8-(sec-butylsulfanyl)-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione|8-sec-Butylsulfanyl-3-methyl-7-(3-phenyl-propyl)-3,7-dihydro-purine-2,6-dione
| Molecular Formula | C19H24N4O2S |
|---|---|
| Molecular Weight | 372.162 g/mol |
| LogP | 2.9467 |
| Topological Polar Surface Area | 72.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 372.162 |
| Monoisotopic Mass | 372.162 |
| Heavy Atoms | 26 |
| Complexity | 1004.0364 |
Chemical Identifiers
| CAS Number | 369604-02-4 |
|---|---|
| SMILES | CCC(C)SC1=NC2=C(N1CCCC3=CC=CC=C3)C(=O)NC(=O)N2C |
Product Overview
8-(sec-butylthio)-3-methyl-7-(3-phenylpropyl)-1H-purine-2,6(3H,7H)-dione (CAS 369604-02-4), with molecular formula C19H24N4O2S and molecular weight 372.162 g/mol. IUPAC: 8-butan-2-ylsulfanyl-3-methyl-7-(3-phenylpropyl)purine-2,6-dione.