AC1NKEB6
3-(4-fluorophenyl)-8-(3-nitrophenyl)-6-oxo-2,4,7,8-tetrahydropyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Also Known As: SR-01000096912-1|3-(4-fluorophenyl)-8-(3-nitrophenyl)-6-oxo-2,3,4,6,7,8-hexahydropyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile|3-(4-fluorophenyl)-8-(3-nitrophenyl)-6-oxo-2,4,7,8-tetrahydropyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile|3-(4-FLUOROPHENYL)-8-(3-NITROPHENYL)-6-OXO-2H,3H,4H,6H,7H,8H-PYRIDO[2,1-B][1,3,5]THIADIAZINE-9-CARBONITRILE|3-(4-fluorophenyl)-8-(3-nitrophenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
| Molecular Formula | C20H15FN4O3S |
|---|---|
| Molecular Weight | 410.0849 g/mol |
| LogP | 3.95338 |
| Topological Polar Surface Area | 90.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 410.0849 |
| Monoisotopic Mass | 410.0849 |
| Heavy Atoms | 29 |
| Complexity | 1064.1411 |
Chemical Identifiers
| CAS Number | 879461-47-9 |
|---|---|
| SMILES | C1C(C(=C2N(C1=O)CN(CS2)C3=CC=C(C=C3)F)C#N)C4=CC(=CC=C4)[N+](=O)[O-] |
Product Overview
AC1NKEB6 (CAS 879461-47-9), with molecular formula C20H15FN4O3S and molecular weight 410.0849 g/mol. IUPAC: 3-(4-fluorophenyl)-8-(3-nitrophenyl)-6-oxo-2,4,7,8-tetrahydropyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile.
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