AC1LZ0TI
1-(2-bromophenyl)-2-[(4-phenyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone
Also Known As: 1-(2-bromophenyl)-2-[(4-phenyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone|1-(2-bromophenyl)-2-((4-phenyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl)thio)ethanone|1-(2-bromophenyl)-2-(4-phenyl-5-pyrazin-2-yl(1,2,4-triazol-3-ylthio))ethan-1-o ne|1-(2-bromophenyl)-2-{[4-phenyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone|1-(2-bromophenyl)-2-{[4-phenyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one
| Molecular Formula | C20H14BrN5OS |
|---|---|
| Molecular Weight | 451.01025 g/mol |
| LogP | 4.4618 |
| Topological Polar Surface Area | 73.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 451.01025 |
| Monoisotopic Mass | 451.01025 |
| Heavy Atoms | 28 |
| Complexity | 1102.0563 |
Chemical Identifiers
| CAS Number | 899395-89-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)C3=CC=CC=C3Br)C4=NC=CN=C4 |
Product Overview
AC1LZ0TI (CAS 899395-89-2), with molecular formula C20H14BrN5OS and molecular weight 451.01025 g/mol. IUPAC: 1-(2-bromophenyl)-2-[(4-phenyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone.
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