AC1LD89G
1,3-dimethyl-8-(2-morpholin-4-ylethylsulfanyl)-7-(naphthalen-1-ylmethyl)purine-2,6-dione
Also Known As: 1,3-Dimethyl-8-((2-morpholinoethyl)thio)-7-(naphthalen-1-ylmethyl)-1H-purine-2,6(3H,7H)-dione|1,3-dimethyl-8-{[2-(morpholin-4-yl)ethyl]sulfanyl}-7-[(naphthalen-1-yl)methyl]-2,3,6,7-tetrahydro-1H-purine-2,6-dione|1,3-dimethyl-8-(2-morpholin-4-ylethylsulfanyl)-7-(naphthalen-1-ylmethyl)purine-2,6-dione|1,3-DIMETHYL-8-{[2-(4-MORPHOLINYL)ETHYL]SULFANYL}-7-(1-NAPHTHYLMETHYL)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE|1,3-dimethyl-8-{[2-(morpholin-4-yl)ethyl]sulfanyl}-7-(naphthalen-1-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
| Molecular Formula | C24H27N5O3S |
|---|---|
| Molecular Weight | 465.18347 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 96.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 465.18347 |
| Monoisotopic Mass | 465.18347 |
| Heavy Atoms | 33 |
| Complexity | 720.0 |
Chemical Identifiers
| CAS Number | 476480-45-2 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)SCCN3CCOCC3)CC4=CC=CC5=CC=CC=C54 |
| InChIKey | UIQJJFMJOYSKSR-UHFFFAOYSA-N |
Product Overview
AC1LD89G (CAS 476480-45-2), with molecular formula C24H27N5O3S and molecular weight 465.18347 g/mol. IUPAC: 1,3-dimethyl-8-(2-morpholin-4-ylethylsulfanyl)-7-(naphthalen-1-ylmethyl)purine-2,6-dione.
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