AC1LONH9
N-cyclopentyl-2-[1,3-dimethyl-2,6-dioxo-7-[[3-(trifluoromethyl)phenyl]methyl]purin-8-yl]sulfanylacetamide
Also Known As: A3617/0153372|N-cyclopentyl-2-[1,3-dimethyl-2,6-dioxo-7-[[3-(trifluoromethyl)phenyl]methyl]purin-8-yl]sulfanylacetamide|N-cyclopentyl-2-((1,3-dimethyl-2,6-dioxo-7-(3-(trifluoromethyl)benzyl)-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)acetamide|N-cyclopentyl-2-({1,3-dimethyl-2,6-dioxo-7-[3-(trifluoromethyl)benzyl]-2,3,6,7-tetrahydro-1H-purin-8-yl}sulfanyl)acetamide|N-CYCLOPENTYL-2-[(1,3-DIMETHYL-2,6-DIOXO-7-{[3-(TRIFLUOROMETHYL)PHENYL]METHYL}-2,3,6,7-TETRAHYDRO-1H-PURIN-8-YL)SULFANYL]ACETAMIDE
| Molecular Formula | C22H24F3N5O3S |
|---|---|
| Molecular Weight | 495.15518 g/mol |
| LogP | 2.6517 |
| Topological Polar Surface Area | 90.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 495.15518 |
| Monoisotopic Mass | 495.15518 |
| Heavy Atoms | 34 |
| Complexity | 1352.7849 |
Chemical Identifiers
| CAS Number | 697231-00-8 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)SCC(=O)NC3CCCC3)CC4=CC(=CC=C4)C(F)(F)F |
Product Overview
AC1LONH9 (CAS 697231-00-8), with molecular formula C22H24F3N5O3S and molecular weight 495.15518 g/mol. IUPAC: N-cyclopentyl-2-[1,3-dimethyl-2,6-dioxo-7-[[3-(trifluoromethyl)phenyl]methyl]purin-8-yl]sulfanylacetamide.
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