AC1MJ7UF
7-[3-(4-chlorophenoxy)-2-hydroxypropyl]-8-(2-hydroxyethylamino)-3-methylpurine-2,6-dione
Also Known As: Oprea1_469010|Oprea1_493030|BAS 00458019|AG-690/36880005|F0373-0606|7-(3-(4-chlorophenoxy)-2-hydroxypropyl)-8-((2-hydroxyethyl)amino)-3-methyl-1H-purine-2,6(3H,7H)-dione|7-[3-(4-chlorophenoxy)-2-hydroxypropyl]-8-[(2-hydroxyethyl)amino]-3-methyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione|7-[3-(4-chlorophenoxy)-2-hydroxypropyl]-8-(2-hydroxyethylamino)-3-methylpurine-2,6-dione|7-[3-(4-chlorophenoxy)-2-hydroxypropyl]-8-[(2-hydroxyethyl)amino]-3-methyl-3,7-dihydro-1H-purine-2,6-dione|7-[3-(4-chlorophenoxy)-2-hydroxypropyl]-8-[(2-hydroxyethyl)amino]-3-methyl-1,3 ,7-trihydropurine-2,6-dione
| Molecular Formula | C17H20ClN5O5 |
|---|---|
| Molecular Weight | 409.1153 g/mol |
| LogP | -0.0792 |
| Topological Polar Surface Area | 134.4 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 409.1153 |
| Monoisotopic Mass | 409.1153 |
| Heavy Atoms | 28 |
| Complexity | 1072.4622 |
Chemical Identifiers
| CAS Number | 331675-17-3 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)N(C(=N2)NCCO)CC(COC3=CC=C(C=C3)Cl)O |
Product Overview
AC1MJ7UF (CAS 331675-17-3), with molecular formula C17H20ClN5O5 and molecular weight 409.1153 g/mol. IUPAC: 7-[3-(4-chlorophenoxy)-2-hydroxypropyl]-8-(2-hydroxyethylamino)-3-methylpurine-2,6-dione.
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