7-(4-chlorobenzyl)-3-methyl-8-(nonylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
7-[(4-chlorophenyl)methyl]-3-methyl-8-nonylsulfanylpurine-2,6-dione
Also Known As: BAS 00553010|7-(4-chlorobenzyl)-3-methyl-8-(nonylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione|7-(4-Chloro-benzyl)-3-methyl-8-nonylsulfanyl-3,7-dihydro-purine-2,6-dione|7-(4-chlorobenzyl)-3-methyl-8-(nonylthio)-1H-purine-2,6(3H,7H)-dione|7-[(4-chlorophenyl)methyl]-3-methyl-8-nonylsulfanylpurine-2,6-dione|7-[(4-chlorophenyl)methyl]-3-methyl-8-nonylthio-1,3,7-trihydropurine-2,6-dione
| Molecular Formula | C22H29ClN4O2S |
|---|---|
| Molecular Weight | 448.16998 g/mol |
| LogP | 4.9677 |
| Topological Polar Surface Area | 72.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 448.16998 |
| Monoisotopic Mass | 448.16998 |
| Heavy Atoms | 30 |
| Complexity | 1085.441 |
Chemical Identifiers
| CAS Number | 369604-48-8 |
|---|---|
| SMILES | CCCCCCCCCSC1=NC2=C(N1CC3=CC=C(C=C3)Cl)C(=O)NC(=O)N2C |
Product Overview
7-(4-chlorobenzyl)-3-methyl-8-(nonylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione (CAS 369604-48-8), with molecular formula C22H29ClN4O2S and molecular weight 448.16998 g/mol. IUPAC: 7-[(4-chlorophenyl)methyl]-3-methyl-8-nonylsulfanylpurine-2,6-dione.
7-(4-chlorobenzyl)-3-methyl-8-(nonylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione is a custom synthesis product. We offer services from milligram to kilogram scale.
Request a Quote »