AC1NRM9R
5-[[3-(4-hexoxyphenyl)-1-phenylpyrazol-4-yl]methylidene]-2-(4-pentoxyphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one
Also Known As: 5-({3-[4-(Hexyloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-2-[4-(pentyloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one|5-[[3-(4-hexoxyphenyl)-1-phenylpyrazol-4-yl]methylidene]-2-(4-pentoxyphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one
CAS: 7066-85-5
| Molecular Formula | C37H39N5O3S |
|---|---|
| Molecular Weight | 633.27734 g/mol |
| LogP | 7.7465 |
| Topological Polar Surface Area | 83.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 15 |
| Exact Mass | 633.27734 |
| Monoisotopic Mass | 633.27734 |
| Heavy Atoms | 46 |
| Complexity | 1962.1178 |
Chemical Identifiers
| CAS Number | 7066-85-5 |
|---|---|
| SMILES | CCCCCCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5=CC=C(C=C5)OCCCCC)S3)C6=CC=CC=C6 |
Product Overview
AC1NRM9R (CAS 7066-85-5), with molecular formula C37H39N5O3S and molecular weight 633.27734 g/mol. IUPAC: 5-[[3-(4-hexoxyphenyl)-1-phenylpyrazol-4-yl]methylidene]-2-(4-pentoxyphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one.
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.
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