AC1LP6XY
2-ethyl-7-[4-(2-methylquinolin-4-yl)piperazin-1-yl]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Also Known As: ChemDiv2_004709|IDI1_003424|2-ethyl-7-(4-(2-methylquinolin-4-yl)piperazin-1-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one|2-ethyl-7-[4-(2-methylquinolin-4-yl)piperazin-1-yl]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one|2-ethyl-7-[4-(2-methyl-4-quinolinyl)-1-piperazinyl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one|2-ethyl-7-[4-(2-methylquinolin-4-yl)piperazin-1-yl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
| Molecular Formula | C21H22N6OS |
|---|---|
| Molecular Weight | 406.1576 g/mol |
| LogP | 2.89662 |
| Topological Polar Surface Area | 66.63 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 406.1576 |
| Monoisotopic Mass | 406.1576 |
| Heavy Atoms | 29 |
| Complexity | 1255.2347 |
Chemical Identifiers
| CAS Number | 593237-40-2 |
|---|---|
| SMILES | CCC1=NN2C(=O)C=C(N=C2S1)N3CCN(CC3)C4=CC(=NC5=CC=CC=C54)C |
Product Overview
AC1LP6XY (CAS 593237-40-2), with molecular formula C21H22N6OS and molecular weight 406.1576 g/mol. IUPAC: 2-ethyl-7-[4-(2-methylquinolin-4-yl)piperazin-1-yl]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one.
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