AC1M024X
(6Z)-5-imino-6-[[3-methoxy-4-(naphthalen-1-ylmethoxy)phenyl]methylidene]-2-pyridin-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Also Known As: (6Z)-5-imino-6-[[3-methoxy-4-(naphthalen-1-ylmethoxy)phenyl]methylidene]-2-pyridin-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one|(6Z)-5-imino-6-[3-methoxy-4-(naphthalen-1-ylmethoxy)benzylidene]-2-(pyridin-3-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one|(Z)-5-imino-6-(3-methoxy-4-(naphthalen-1-ylmethoxy)benzylidene)-2-(pyridin-3-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one
| Molecular Formula | C29H21N5O3S |
|---|---|
| Molecular Weight | 519.13654 g/mol |
| LogP | 5.48987 |
| Topological Polar Surface Area | 100.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 519.13654 |
| Monoisotopic Mass | 519.13654 |
| Heavy Atoms | 38 |
| Complexity | 1675.2133 |
Chemical Identifiers
| CAS Number | 577697-89-3 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)/C=C\2/C(=N)N3C(=NC2=O)SC(=N3)C4=CN=CC=C4)OCC5=CC=CC6=CC=CC=C65 |
Product Overview
AC1M024X (CAS 577697-89-3), with molecular formula C29H21N5O3S and molecular weight 519.13654 g/mol. IUPAC: (6Z)-5-imino-6-[[3-methoxy-4-(naphthalen-1-ylmethoxy)phenyl]methylidene]-2-pyridin-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one.