AC1MFTDE
ethyl 4-amino-2-[1-(3-fluorophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylpyrimidine-5-carboxylate
Also Known As: CBKinase1_005274|CBKinase1_017674|SR-01000272043-1|BRD-A20569306-001-01-6|ethyl 4-amino-2-{[1-(3-fluorophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}pyrimidine-5-carboxylate|ethyl 4-amino-2-((1-(3-fluorophenyl)-2,5-dioxopyrrolidin-3-yl)thio)pyrimidine-5-carboxylate|ethyl 4-amino-2-[1-(3-fluorophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylpyrimidine-5-carboxylate|ethyl 4-amino-2-{[1-(3-fluorophenyl)-2,5-dioxo-3-pyrrolidinyl]thio}-5-pyrimidinecarboxylate
| Molecular Formula | C17H15FN4O4S |
|---|---|
| Molecular Weight | 390.0798 g/mol |
| LogP | 1.7988 |
| Topological Polar Surface Area | 115.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 390.0798 |
| Monoisotopic Mass | 390.0798 |
| Heavy Atoms | 27 |
| Complexity | 923.55646 |
Chemical Identifiers
| CAS Number | 700855-56-7 |
|---|---|
| SMILES | CCOC(=O)C1=CN=C(N=C1N)SC2CC(=O)N(C2=O)C3=CC(=CC=C3)F |
Product Overview
AC1MFTDE (CAS 700855-56-7), with molecular formula C17H15FN4O4S and molecular weight 390.0798 g/mol. IUPAC: ethyl 4-amino-2-[1-(3-fluorophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylpyrimidine-5-carboxylate.
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