AC1OBTPI
N-[(E)-[4-(diethylamino)phenyl]methylideneamino]-2-[[4-(4-methoxyphenyl)-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: N'-{(E)-[4-(diethylamino)phenyl]methylidene}-2-{[4-(4-methoxyphenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide|(E)-N'-(4-(diethylamino)benzylidene)-2-((4-(4-methoxyphenyl)-5-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)acetohydrazide|N-[(E)-[4-(diethylamino)phenyl]methylideneamino]-2-[[4-(4-methoxyphenyl)-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide|N-{(1E)-2-[4-(diethylamino)phenyl]-1-azavinyl}-2-[4-(4-methoxyphenyl)-5-(4-met hylphenyl)(1,2,4-triazol-3-ylthio)]acetamide
| Molecular Formula | C29H32N6O2S |
|---|---|
| Molecular Weight | 528.2308 g/mol |
| LogP | 5.33992 |
| Topological Polar Surface Area | 84.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 528.2308 |
| Monoisotopic Mass | 528.2308 |
| Heavy Atoms | 38 |
| Complexity | 1361.961 |
Chemical Identifiers
| CAS Number | 406465-52-9 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)/C=N/NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)OC)C4=CC=C(C=C4)C |
Product Overview
AC1OBTPI (CAS 406465-52-9), with molecular formula C29H32N6O2S and molecular weight 528.2308 g/mol. IUPAC: N-[(E)-[4-(diethylamino)phenyl]methylideneamino]-2-[[4-(4-methoxyphenyl)-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.
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