AC1NKGPU
[5-(3-methylbutyl)-8-pentyl-5,7,9,16-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(16),2(6),3,7,10,12,14-heptaen-3-yl] hexanoate
Also Known As: 3-isopentyl-5-pentyl-3H-benzo[4,5]imidazo[1,2-c]pyrrolo[3,2-e]pyrimidin-1-yl hexanoate|3-(3-methylbutyl)-5-pentyl-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl hexanoate
CAS: 885174-33-4
| Molecular Formula | C28H38N4O2 |
|---|---|
| Molecular Weight | 462.29947 g/mol |
| LogP | 7.1017 |
| Topological Polar Surface Area | 61.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 462.29947 |
| Monoisotopic Mass | 462.29947 |
| Heavy Atoms | 34 |
| Complexity | 1268.1108 |
Chemical Identifiers
| CAS Number | 885174-33-4 |
|---|---|
| SMILES | CCCCCC1=NC2=C(C(=CN2CCC(C)C)OC(=O)CCCCC)C3=NC4=CC=CC=C4N13 |
Product Overview
AC1NKGPU (CAS 885174-33-4), with molecular formula C28H38N4O2 and molecular weight 462.29947 g/mol. IUPAC: [5-(3-methylbutyl)-8-pentyl-5,7,9,16-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(16),2(6),3,7,10,12,14-heptaen-3-yl] hexanoate.
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.
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