AC1LXQJC
(E)-2-(benzenesulfonyl)-3-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-3-yl)prop-2-enenitrile
Also Known As: (E)-3-(2-morpholino-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-(phenylsulfonyl)acrylonitrile|(2E)-2-(BENZENESULFONYL)-3-[2-(MORPHOLIN-4-YL)-4-OXO-4H-PYRIDO[1,2-A]PYRIMIDIN-3-YL]PROP-2-ENENITRILE|(2E)-3-[2-(morpholin-4-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-(phenylsulfonyl)prop-2-enenitrile|(E)-2-(benzenesulfonyl)-3-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-3-yl)prop-2-enenitrile
| Molecular Formula | C21H18N4O4S |
|---|---|
| Molecular Weight | 422.1049 g/mol |
| LogP | 1.86948 |
| Topological Polar Surface Area | 104.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 422.1049 |
| Monoisotopic Mass | 422.1049 |
| Heavy Atoms | 30 |
| Complexity | 1318.6089 |
Chemical Identifiers
| CAS Number | 1164539-72-3 |
|---|---|
| SMILES | C1COCCN1C2=C(C(=O)N3C=CC=CC3=N2)/C=C(\C#N)/S(=O)(=O)C4=CC=CC=C4 |
Product Overview
AC1LXQJC (CAS 1164539-72-3), with molecular formula C21H18N4O4S and molecular weight 422.1049 g/mol. IUPAC: (E)-2-(benzenesulfonyl)-3-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-3-yl)prop-2-enenitrile.
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