ChemDiv3_014368
ethyl 4-[7,7-dimethyl-2,5-dioxo-4,4-bis(trifluoromethyl)-6,8-dihydro-3H-quinazolin-1-yl]benzoate
Also Known As: ChemDiv3_014368|IDI1_030166|ethyl 4-[7,7-dimethyl-2,5-dioxo-4,4-bis(trifluoromethyl)-6,8-dihydro-3H-quinazolin-1-yl]benzoate|ethyl 4-(7,7-dimethyl-2,5-dioxo-4,4-bis(trifluoromethyl)-3,4,5,6,7,8-hexahydroquinazolin-1(2H)-yl)benzoate|ethyl 4-[2-hydroxy-7,7-dimethyl-5-oxo-4,4-bis(trifluoromethyl)-5,6,7,8-tetrahydroquinazolin-1(4H)-yl]benzoate|ETHYL 4-[7,7-DIMETHYL-2,5-DIOXO-4,4-BIS(TRIFLUOROMETHYL)-1,2,3,4,5,6,7,8-OCTAHYDROQUINAZOLIN-1-YL]BENZOATE
| Molecular Formula | C21H20F6N2O4 |
|---|---|
| Molecular Weight | 478.13272 g/mol |
| LogP | 4.8995 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 478.13272 |
| Monoisotopic Mass | 478.13272 |
| Heavy Atoms | 33 |
| Complexity | 1010.67584 |
Chemical Identifiers
| CAS Number | 712346-76-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N2C3=C(C(=O)CC(C3)(C)C)C(NC2=O)(C(F)(F)F)C(F)(F)F |
Product Overview
ChemDiv3_014368 (CAS 712346-76-4), with molecular formula C21H20F6N2O4 and molecular weight 478.13272 g/mol. IUPAC: ethyl 4-[7,7-dimethyl-2,5-dioxo-4,4-bis(trifluoromethyl)-6,8-dihydro-3H-quinazolin-1-yl]benzoate.
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