AC1O3HQH
(6Z)-5-imino-2-(2-oxo-2-piperidin-1-ylethyl)-6-[[4-(1-phenylethoxy)phenyl]methylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Also Known As: (6Z)-5-imino-2-(2-oxo-2-piperidin-1-ylethyl)-6-[[4-(1-phenylethoxy)phenyl]methylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one|(6Z)-5-imino-2-[2-oxo-2-(piperidin-1-yl)ethyl]-6-[4-(1-phenylethoxy)benzylidene]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one|(Z)-5-imino-2-(2-oxo-2-(piperidin-1-yl)ethyl)-6-(4-(1-phenylethoxy)benzylidene)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one
| Molecular Formula | C27H27N5O3S |
|---|---|
| Molecular Weight | 501.18347 g/mol |
| LogP | 4.84837 |
| Topological Polar Surface Area | 98.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 501.18347 |
| Monoisotopic Mass | 501.18347 |
| Heavy Atoms | 36 |
| Complexity | 1264.0741 |
Chemical Identifiers
| CAS Number | 848669-35-2 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)OC2=CC=C(C=C2)/C=C\3/C(=N)N4C(=NC3=O)SC(=N4)CC(=O)N5CCCCC5 |
Product Overview
AC1O3HQH (CAS 848669-35-2), with molecular formula C27H27N5O3S and molecular weight 501.18347 g/mol. IUPAC: (6Z)-5-imino-2-(2-oxo-2-piperidin-1-ylethyl)-6-[[4-(1-phenylethoxy)phenyl]methylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one.