AC1OAZ89
2-[[3-(4-methylphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]-N-[(E)-(4-nitrophenyl)methylideneamino]acetamide
Also Known As: (E)-N'-(4-nitrobenzylidene)-2-((4-oxo-3-(p-tolyl)-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetohydrazide|2-[[3-(4-methylphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]-N-[(E)-(4-nitrophenyl)methylideneamino]acetamide|2-{[3-(4-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N'-[(E)-(4-nitrophenyl)methylidene]acetohydrazide
| Molecular Formula | C26H23N5O4S2 |
|---|---|
| Molecular Weight | 533.11914 g/mol |
| LogP | 4.78502 |
| Topological Polar Surface Area | 119.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 533.11914 |
| Monoisotopic Mass | 533.11914 |
| Heavy Atoms | 37 |
| Complexity | 1574.0527 |
Chemical Identifiers
| CAS Number | 613231-75-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)N/N=C/C4=CC=C(C=C4)[N+](=O)[O-])SC5=C3CCCC5 |
Product Overview
AC1OAZ89 (CAS 613231-75-7), with molecular formula C26H23N5O4S2 and molecular weight 533.11914 g/mol. IUPAC: 2-[[3-(4-methylphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]-N-[(E)-(4-nitrophenyl)methylideneamino]acetamide.