AC1OBND6
4-[(E)-[4-(diethylamino)phenyl]methylideneamino]-3-(4-ethoxyphenyl)-1H-1,2,4-triazole-5-thione
Also Known As: (E)-4-((4-(diethylamino)benzylidene)amino)-5-(4-ethoxyphenyl)-4H-1,2,4-triazole-3-thiol|4-({(E)-[4-(diethylamino)phenyl]methylidene}amino)-5-(4-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione|4-[(E)-[4-(diethylamino)phenyl]methylideneamino]-3-(4-ethoxyphenyl)-1H-1,2,4-triazole-5-thione
CAS: 613250-17-2
| Molecular Formula | C21H25N5OS |
|---|---|
| Molecular Weight | 395.17798 g/mol |
| LogP | 4.73479 |
| Topological Polar Surface Area | 58.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 395.17798 |
| Monoisotopic Mass | 395.17798 |
| Heavy Atoms | 28 |
| Complexity | 969.2806 |
Chemical Identifiers
| CAS Number | 613250-17-2 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)/C=N/N2C(=NNC2=S)C3=CC=C(C=C3)OCC |
Product Overview
AC1OBND6 (CAS 613250-17-2), with molecular formula C21H25N5OS and molecular weight 395.17798 g/mol. IUPAC: 4-[(E)-[4-(diethylamino)phenyl]methylideneamino]-3-(4-ethoxyphenyl)-1H-1,2,4-triazole-5-thione.
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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