AC1N48GW
ethyl 4-(1-ethyl-5-methylpyrazol-4-yl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
Also Known As: Oprea1_450565|AK-968/41017394|ethyl 4-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate|ethyl 4-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate|ethyl 4-(1-ethyl-5-methylpyrazol-4-yl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
| Molecular Formula | C21H29N3O3 |
|---|---|
| Molecular Weight | 371.2209 g/mol |
| LogP | 3.37852 |
| Topological Polar Surface Area | 73.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 371.2209 |
| Monoisotopic Mass | 371.2209 |
| Heavy Atoms | 27 |
| Complexity | 858.0229 |
Chemical Identifiers
| CAS Number | 492425-19-1 |
|---|---|
| SMILES | CCN1C(=C(C=N1)C2C3=C(CC(CC3=O)(C)C)NC(=C2C(=O)OCC)C)C |
Product Overview
AC1N48GW (CAS 492425-19-1), with molecular formula C21H29N3O3 and molecular weight 371.2209 g/mol. IUPAC: ethyl 4-(1-ethyl-5-methylpyrazol-4-yl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate.
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