AC1O1YKK
(E)-2-(1,3-benzothiazol-2-yl)-3-[2-(4-methoxyphenoxy)-4-oxopyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
Also Known As: (2E)-2-(1,3-benzothiazol-2-yl)-3-[2-(4-methoxyphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile|(E)-2-(1,3-benzothiazol-2-yl)-3-[2-(4-methoxyphenoxy)-4-oxopyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile|(E)-2-(benzo[d]thiazol-2-yl)-3-(2-(4-methoxyphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)acrylonitrile
CAS: 620105-95-5
| Molecular Formula | C25H16N4O3S |
|---|---|
| Molecular Weight | 452.0943 g/mol |
| LogP | 5.16928 |
| Topological Polar Surface Area | 89.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 452.0943 |
| Monoisotopic Mass | 452.0943 |
| Heavy Atoms | 33 |
| Complexity | 1578.4117 |
Chemical Identifiers
| CAS Number | 620105-95-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)OC2=C(C(=O)N3C=CC=CC3=N2)/C=C(\C#N)/C4=NC5=CC=CC=C5S4 |
Product Overview
AC1O1YKK (CAS 620105-95-5), with molecular formula C25H16N4O3S and molecular weight 452.0943 g/mol. IUPAC: (E)-2-(1,3-benzothiazol-2-yl)-3-[2-(4-methoxyphenoxy)-4-oxopyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile.
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 →
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