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Letrazuril

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Category Human immunodeficiency Virus (HIV)
CAS 103337-74-2
Description Letrazuril is an anti-HIV agent. It is also an antiprotozoal agent that is effective against cryptosporidium infections.
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Product Information

Synonyms 2-(2,6-Dichloro-4-(3,5-dioxo-4,5-dihydro-1,2,4-triazin-2(3H)-yl)phenyl)-2-(4-fluorophenyl)acetonitrile; Benzeneacetonitrile, 2,6-dichloro-4-(4,5-dihydro-3,5-dioxo-1,2,4-triazin-2(3H)-yl)-α-(4-fluorophenyl)-; (±)-(2,6-Dichloro-4-(4,5-dihydro-3,5-dioxo-as-triazin-2(3H)-yl)phenyl)(p-fluorophenyl)acetonitrile
IUPAC Name 2-[2,6-dichloro-4-(3,5-dioxo-1,2,4-triazin-2-yl)phenyl]-2-(4-fluorophenyl)acetonitrile
Molecular Weight 391.18
Molecular Formula C17H9Cl2FN4O2
Canonical SMILES C1=CC(=CC=C1C(C#N)C2=C(C=C(C=C2Cl)N3C(=O)NC(=O)C=N3)Cl)F
InChI InChI=1S/C17H9Cl2FN4O2/c18-13-5-11(24-17(26)23-15(25)8-22-24)6-14(19)16(13)12(7-21)9-1-3-10(20)4-2-9/h1-6,8,12H,(H,23,25,26)
InChIKey XQKYUBTUOHHNDV-UHFFFAOYSA-N
Purity 95%
Density 1.54±0.1 g/cm3
Solubility Soluble in DMSO
Appearance Solid Powder
Storage Store at 2-8°C for short term (days to weeks) or -20°C for long term (months to years)
Complexity 632
Exact Mass 390.0086591
Index Of Refraction 1.681
PSA 91.80000
Target HIV
XLogP3-AA 3.5

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