RefChem:464174
2-amino-4-(5-bromothiophen-2-yl)-1-(4-nitrophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile
Also Known As: ChemDiv1_011191|HMS618M15|2-amino-4-(5-bromothiophen-2-yl)-1-(4-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile|AG-205/10431059|A1152/0053878|SR-01000513665-1|2-amino-4-(5-bromo-2-thienyl)-1-(4-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile|2-amino-4-(5-bromo-2-thienyl)-1-{4-nitrophenyl}-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile|2-amino-4-(5-bromothiophen-2-yl)-1-(4-nitrophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile|648-211-2
| Molecular Formula | C20H15BrN4O3S |
|---|---|
| Molecular Weight | 470.00482 g/mol |
| LogP | 4.72358 |
| Topological Polar Surface Area | 113.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 470.00482 |
| Monoisotopic Mass | 470.00482 |
| Heavy Atoms | 29 |
| Complexity | 1127.3402 |
Chemical Identifiers
| CAS Number | 311331-23-4 |
|---|---|
| SMILES | C1CC2=C(C(C(=C(N2C3=CC=C(C=C3)[N+](=O)[O-])N)C#N)C4=CC=C(S4)Br)C(=O)C1 |
Product Overview
RefChem:464174 (CAS 311331-23-4), with molecular formula C20H15BrN4O3S and molecular weight 470.00482 g/mol. IUPAC: 2-amino-4-(5-bromothiophen-2-yl)-1-(4-nitrophenyl)-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile.