AC1MS6TE
2-(6-benzyl-2,5-dimethyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)sulfanyl-1-thiophen-2-ylethanone
Also Known As: 2-[(6-benzyl-2,5-dimethyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)sulfanyl]-1-(thiophen-2-yl)ethanone|2-((6-benzyl-2,5-dimethyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)thio)-1-(thiophen-2-yl)ethanone|2-(6-benzyl-2,5-dimethyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)sulfanyl-1-thiophen-2-ylethanone|2-[2,5-dimethyl-3-phenyl-6-benzyl(8-hydropyrazolo[1,5-a]pyrimidin-7-ylthio)]-1 -(2-thienyl)ethan-1-one
| Molecular Formula | C27H23N3OS2 |
|---|---|
| Molecular Weight | 469.12827 g/mol |
| LogP | 6.64044 |
| Topological Polar Surface Area | 47.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 469.12827 |
| Monoisotopic Mass | 469.12827 |
| Heavy Atoms | 33 |
| Complexity | 1408.8307 |
Chemical Identifiers
| CAS Number | 862192-74-3 |
|---|---|
| SMILES | CC1=NC2=C(C(=NN2C(=C1CC3=CC=CC=C3)SCC(=O)C4=CC=CS4)C)C5=CC=CC=C5 |
Product Overview
AC1MS6TE (CAS 862192-74-3), with molecular formula C27H23N3OS2 and molecular weight 469.12827 g/mol. IUPAC: 2-(6-benzyl-2,5-dimethyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)sulfanyl-1-thiophen-2-ylethanone.
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