ST50706762
oxolan-2-ylmethyl 2,7,7-trimethyl-5-oxo-4-(4-oxochromen-3-yl)-1,4,6,8-tetrahydroquinoline-3-carboxylate
Also Known As: ChemDiv1_003198|Oprea1_292229|Oprea1_564317|HMS596B08|BAS 02169823|AB00100030-01|SR-01000432090-1|tetrahydro-2-furanylmethyl 2,7,7-trimethyl-5-oxo-4-(4-oxo-4H-chromen-3-yl)-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate|tetrahydrofuran-2-ylmethyl 2,7,7-trimethyl-5-oxo-4-(4-oxo-4H-chromen-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate|oxolan-2-ylmethyl 2,7,7-trimethyl-5-oxo-4-(4-oxochromen-3-yl)-1,4,6,8-tetrahydroquinoline-3-carboxylate|(Oxolan-2-yl)methyl 2,7,7-trimethyl-5-oxo-4-(4-oxo-4H-1-benzopyran-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate|oxolan-2-ylmethyl 2,7,7-trimethyl-5-oxo-4-(4-oxochromen-3-yl)-1,4,6,7,8-pentah ydroquinoline-3-carboxylate
| Molecular Formula | C27H29NO6 |
|---|---|
| Molecular Weight | 463.1995 g/mol |
| LogP | 4.1192 |
| Topological Polar Surface Area | 94.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 463.1995 |
| Monoisotopic Mass | 463.1995 |
| Heavy Atoms | 34 |
| Complexity | 1291.6868 |
Chemical Identifiers
| CAS Number | 5875-68-3 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=COC4=CC=CC=C4C3=O)C(=O)OCC5CCCO5 |
Product Overview
ST50706762 (CAS 5875-68-3), with molecular formula C27H29NO6 and molecular weight 463.1995 g/mol. IUPAC: oxolan-2-ylmethyl 2,7,7-trimethyl-5-oxo-4-(4-oxochromen-3-yl)-1,4,6,8-tetrahydroquinoline-3-carboxylate.