AC1N7ISS
2-[[1-[3-(4-acetylphenoxy)-2-hydroxypropyl]piperidin-4-yl]methyl]benzo[de]isoquinoline-1,3-dione
Also Known As: SR-01000496973-1|F1082-0142|2-((1-(3-(4-acetylphenoxy)-2-hydroxypropyl)piperidin-4-yl)methyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione|3-({1-[3-(4-acetylphenoxy)-2-hydroxypropyl]piperidin-4-yl}methyl)-3-azatricyclo[7.3.1.0^{5,13}]trideca-1(12),5,7,9(13),10-pentaene-2,4-dione|2-[[1-[3-(4-acetylphenoxy)-2-hydroxypropyl]piperidin-4-yl]methyl]benzo[de]isoquinoline-1,3-dione
| Molecular Formula | C29H30N2O5 |
|---|---|
| Molecular Weight | 486.21548 g/mol |
| LogP | 3.7903 |
| Topological Polar Surface Area | 87.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 486.21548 |
| Monoisotopic Mass | 486.21548 |
| Heavy Atoms | 36 |
| Complexity | 1244.0173 |
Chemical Identifiers
| CAS Number | 442556-07-2 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)OCC(CN2CCC(CC2)CN3C(=O)C4=CC=CC5=C4C(=CC=C5)C3=O)O |
Product Overview
AC1N7ISS (CAS 442556-07-2), with molecular formula C29H30N2O5 and molecular weight 486.21548 g/mol. IUPAC: 2-[[1-[3-(4-acetylphenoxy)-2-hydroxypropyl]piperidin-4-yl]methyl]benzo[de]isoquinoline-1,3-dione.
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