AC1MGJQN
3-[(3-chlorophenyl)methylsulfanyl]-4-methyl-5-[(2-methyl-5-nitroimidazol-1-yl)methyl]-1,2,4-triazole
Also Known As: BAS 12238975|A3848/0163471|3-[(3-chlorobenzyl)sulfanyl]-4-methyl-5-[(2-methyl-5-nitro-1H-imidazol-1-yl)methyl]-4H-1,2,4-triazole|3-[(3-chlorophenyl)methylsulfanyl]-4-methyl-5-[(2-methyl-5-nitroimidazol-1-yl)methyl]-1,2,4-triazole|3-((3-chlorobenzyl)thio)-4-methyl-5-((2-methyl-5-nitro-1H-imidazol-1-yl)methyl)-4H-1,2,4-triazole
| Molecular Formula | C15H15ClN6O2S |
|---|---|
| Molecular Weight | 378.06656 g/mol |
| LogP | 3.22222 |
| Topological Polar Surface Area | 91.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 378.06656 |
| Monoisotopic Mass | 378.06656 |
| Heavy Atoms | 25 |
| Complexity | 922.6399 |
Chemical Identifiers
| CAS Number | 728024-18-8 |
|---|---|
| SMILES | CC1=NC=C(N1CC2=NN=C(N2C)SCC3=CC(=CC=C3)Cl)[N+](=O)[O-] |
Product Overview
AC1MGJQN (CAS 728024-18-8), with molecular formula C15H15ClN6O2S and molecular weight 378.06656 g/mol. IUPAC: 3-[(3-chlorophenyl)methylsulfanyl]-4-methyl-5-[(2-methyl-5-nitroimidazol-1-yl)methyl]-1,2,4-triazole.
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