AC1LCQ0D
ethyl 2-(4-methyl-1,3-dioxo-7,8-dihydropurino[8,7-b][1,3]thiazol-2-yl)acetate
Also Known As: Oprea1_392495|Oprea1_644722|ethyl (1-methyl-2,4-dioxo-1,4,6,7-tetrahydro[1,3]thiazolo[2,3-f]purin-3(2H)-yl)acetate|ethyl 2-(4-methyl-1,3-dioxo-7,8-dihydropurino[8,7-b][1,3]thiazol-2-yl)acetate|ethyl 2-(1-methyl-2,4-dioxo-1,2,6,7-tetrahydrothiazolo[2,3-f]purin-3(4H)-yl)acetate|(1-Methyl-2,4-dioxo-1,4,6,7-tetrahydro-2H-thiazolo[2,3-f]purin-3-yl)-acetic acid ethyl ester|ethyl 2-(1-methyl-2,4-dioxo-1,3,5-trihydro-6H,7H-1,3-thiazolidino[3,2-h]purin- 3-yl)acetate|ETHYL 2-{1-METHYL-2,4-DIOXO-1H,2H,3H,4H,6H,7H-[1,3]THIAZOLO[3,2-G]PURIN-3-YL}ACETATE
| Molecular Formula | C12H14N4O4S |
|---|---|
| Molecular Weight | 310.07358 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 310.07358 |
| Monoisotopic Mass | 310.07358 |
| Heavy Atoms | 21 |
| Complexity | 488.0 |
Chemical Identifiers
| CAS Number | 313262-58-7 |
|---|---|
| SMILES | CCOC(=O)CN1C(=O)C2=C(N=C3N2CCS3)N(C1=O)C |
| InChIKey | RDVPHOBBCVPZBP-UHFFFAOYSA-N |
Product Overview
AC1LCQ0D (CAS 313262-58-7), with molecular formula C12H14N4O4S and molecular weight 310.07358 g/mol. IUPAC: ethyl 2-(4-methyl-1,3-dioxo-7,8-dihydropurino[8,7-b][1,3]thiazol-2-yl)acetate.
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