AC1O5L5I
7-(2-hydroxy-2-phenylethyl)-3-methyl-8-(3-morpholin-4-ylpropylamino)purine-2,6-dione
Also Known As: BAS 15375050|VU0512725-1|7-(2-hydroxy-2-phenylethyl)-3-methyl-8-((3-morpholinopropyl)amino)-1H-purine-2,6(3H,7H)-dione|F3176-0207|7-(2-hydroxy-2-phenylethyl)-3-methyl-8-(3-morpholin-4-ylpropylamino)purine-2,6-dione|7-(2-hydroxy-2-phenylethyl)-3-methyl-8-{[3-(morpholin-4-yl)propyl]amino}-2,3,6,7-tetrahydro-1H-purine-2,6-dione|6-hydroxy-7-(2-hydroxy-2-phenylethyl)-3-methyl-8-{[3-(morpholin-4-yl)propyl]amino}-3,7-dihydro-2H-purin-2-one
| Molecular Formula | C21H28N6O4 |
|---|---|
| Molecular Weight | 428.2172 g/mol |
| LogP | 0.2911 |
| Topological Polar Surface Area | 117.41 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 428.2172 |
| Monoisotopic Mass | 428.2172 |
| Heavy Atoms | 31 |
| Complexity | 1130.4629 |
Chemical Identifiers
| CAS Number | 879072-10-3 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)N(C(=N2)NCCCN3CCOCC3)CC(C4=CC=CC=C4)O |
Product Overview
AC1O5L5I (CAS 879072-10-3), with molecular formula C21H28N6O4 and molecular weight 428.2172 g/mol. IUPAC: 7-(2-hydroxy-2-phenylethyl)-3-methyl-8-(3-morpholin-4-ylpropylamino)purine-2,6-dione.
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