AC1LJVOL
8-chloro-6-(2-chlorophenyl)-1-(methylsulfanylmethyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine
Also Known As: Oprea1_561953|4H-(1,2,4)Triazolo(4,3-a)(1,4)benzodiazepine, 8-chloro-6-(2-chlorophenyl)-1-((methylthio)methyl)-|AE-641/30153057|8-chloro-6-(2-chlorophenyl)-1-(methylsulfanylmethyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine|[8-chloro-6-(2-chlorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]methyl methyl sulfide|4H-(1,2,4)Triazolo(4,3-a)(1,4)benzodiazepine,8-chloro-6-(2-chlorophenyl)-1-((methylthio)methyl)|8-Chloro-6-(2-chlorophenyl)-1-[(methylsulfanyl)methyl]-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine
| Molecular Formula | C18H14Cl2N4S |
|---|---|
| Molecular Weight | 388.03162 g/mol |
| LogP | 4.7881 |
| Topological Polar Surface Area | 43.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 388.03162 |
| Monoisotopic Mass | 388.03162 |
| Heavy Atoms | 25 |
| Complexity | 980.95746 |
Chemical Identifiers
| CAS Number | 85677-79-8 |
|---|---|
| SMILES | CSCC1=NN=C2N1C3=C(C=C(C=C3)Cl)C(=NC2)C4=CC=CC=C4Cl |
Product Overview
AC1LJVOL (CAS 85677-79-8), with molecular formula C18H14Cl2N4S and molecular weight 388.03162 g/mol. IUPAC: 8-chloro-6-(2-chlorophenyl)-1-(methylsulfanylmethyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine.
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