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Bersacapavir

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Category Hepatitis B Virus (HBV)
CAS 1638266-40-6
Description Bersacapavir is an assembly modulator of hepatitis B virus capsid.
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Product Information

Synonyms JNJ-6379; JNJ-56136379; 1H-Pyrrole-2-carboxamide, N-(3-cyano-4-fluorophenyl)-1-methyl-4-((((1S)-2,2,2-trifluoro-1-methylethyl)amino)sulfonyl)-; N-(3-Cyano-4-fluorophenyl)-1-methyl-4-(((2S)-1,1,1-trifluoro-2-propanyl)sulfamoyl)-1H-pyrrole-2-carboxamide
IUPAC Name N-(3-cyano-4-fluorophenyl)-1-methyl-4-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]pyrrole-2-carboxamide
Molecular Weight 418.37
Molecular Formula C16H14F4N4O3S
Canonical SMILES CC(C(F)(F)F)NS(=O)(=O)C1=CN(C(=C1)C(=O)NC2=CC(=C(C=C2)F)C#N)C
InChI InChI=1S/C16H14F4N4O3S/c1-9(16(18,19)20)23-28(26,27)12-6-14(24(2)8-12)15(25)22-11-3-4-13(17)10(5-11)7-21/h3-6,8-9,23H,1-2H3,(H,22,25)/t9-/m0/s1
InChIKey SBVBIDUKSBJYEF-VIFPVBQESA-N
Purity ≥98%
Density 1.47±0.1 g/cm3 (Predicted)
Solubility Soluble in DMSO
Appearance Solid Powder
Storage Store at -20°C
Complexity 730
Exact Mass 418.07227414
Index Of Refraction 1.575
Target HBV
XLogP3-AA 2.2

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