AC1LUBLI
N-(5-cyano-11-methyl-2-oxo-7-pentyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-6-ylidene)-3-nitrobenzamide
Also Known As: (E)-N-(3-cyano-10-methyl-5-oxo-1-pentyl-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-2(5H)-ylidene)-3-nitrobenzamide|N-[(2E)-3-cyano-10-methyl-5-oxo-1-pentyl-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidin-2-ylidene]-3-nitrobenzamide
CAS: 714256-52-7
| Molecular Formula | C25H22N6O4 |
|---|---|
| Molecular Weight | 470.17026 g/mol |
| LogP | 3.6688 |
| Topological Polar Surface Area | 135.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 470.17026 |
| Monoisotopic Mass | 470.17026 |
| Heavy Atoms | 35 |
| Complexity | 1659.4236 |
Chemical Identifiers
| CAS Number | 714256-52-7 |
|---|---|
| SMILES | CCCCCN1C2=C(C=C(C1=NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C#N)C(=O)N4C=CC=C(C4=N2)C |
Product Overview
AC1LUBLI (CAS 714256-52-7), with molecular formula C25H22N6O4 and molecular weight 470.17026 g/mol. IUPAC: N-(5-cyano-11-methyl-2-oxo-7-pentyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-6-ylidene)-3-nitrobenzamide.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
AC1LUBLI is a custom synthesis product. We offer services from milligram to kilogram scale.
Request a Quote »