AC1OY25P
1-morpholin-4-yl-3-phenacylsulfanyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Also Known As: AK-968/12265222|1-morpholin-4-yl-3-phenacylsulfanyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile|1-morpholino-3-((2-oxo-2-phenylethyl)thio)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile|1-(4-morpholinyl)-3-[(2-oxo-2-phenylethyl)sulfanyl]-5,6,7,8-tetrahydro-4-isoquinolinecarbonitrile|1-(morpholin-4-yl)-3-[(2-oxo-2-phenylethyl)sulfanyl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
| Molecular Formula | C22H23N3O2S |
|---|---|
| Molecular Weight | 393.1511 g/mol |
| LogP | 3.64368 |
| Topological Polar Surface Area | 66.22 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 393.1511 |
| Monoisotopic Mass | 393.1511 |
| Heavy Atoms | 28 |
| Complexity | 902.2333 |
Chemical Identifiers
| CAS Number | 904008-75-9 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(N=C2N3CCOCC3)SCC(=O)C4=CC=CC=C4)C#N |
Product Overview
AC1OY25P (CAS 904008-75-9), with molecular formula C22H23N3O2S and molecular weight 393.1511 g/mol. IUPAC: 1-morpholin-4-yl-3-phenacylsulfanyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile.
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